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warning messages: "The normals for some stacked continuum shell elements deviate by more than 20 degrees. This can lead errors in the output variables ctsh."
Does anyone know this problem?
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  • Check Element Orientation: Abaqus expects the normals of stacked continuum shell elements to be aligned consistently across the thickness direction. In the Mesh module, review the element orientations to ensure that the normals of each element are aligned consistently in the stacking direction. You can visualize element normals by selecting the option to display “Normal directions” for shells under Mesh > Element Normal.
  • Adjust Part Geometry or Meshing: In some cases, irregular geometry or a complex mesh can cause the normals to deviate. Try simplifying the geometry or refining the mesh in problematic areas to improve alignment. You could also try remeshing with different element sizes or types if possible.
  • Correct Local Element Orientation: Use the Assign Orientation option to manually correct orientations of the misaligned elements. Go to the Property module, assign a material orientation to the affected region, and ensure they all follow the same direction across the stack.
  • Use Continuum Shell Element Options: In the element properties, set the Stacking Direction explicitly in the Continuum Shell settings to avoid misalignment in complex geometries.
  • Check and Adjust Modeling Approaches: If you’re working with complex assemblies, consider breaking up the model into smaller parts or subassemblies, which could help in better aligning the elements.
  • https://caeassistant.com/product/post-fracture-analysis-glass-abaqus/
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In a triangular disc shell nanoparticle with gold shell and air core in the extinction spectrum, we see 4 plasmonic bands at wavelengths of 900, 700, 600 and 500 nm. Which one of them is related to dipole and which one is quadrupole And which ones are 8 poles? Which one of them is bonding and which one is anti-bonding? While for my circular shell nanoparticle, there are two plasmon bands, one around 900 nm and the other around 500 nm. Is 900 nm a bonding dipole and 500 nm is an anti-bonding dipole? What are these middle bands in the triangular state? How to distinguish them from each other?
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Merkez atoma bakılır.
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Core/shell.
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Doping quantum dots (QDs) with plasmonic core/shell structures is primarily intended to improve their optical and electrical properties via a coupling effect between the plasmonic core and quantum dot. The plasmonic core (usually a metal such as gold or silver) can amplify the local electromagnetic field near the QD, resulting in an increased fluorescence signal. Which is especially beneficial in applications that require great sensitivity, such as bioimaging and sensing. The plasmonic core's resonance frequency can be adjusted to match the QD's emission or absorption spectra, allowing for controlled energy transfer (Förster resonance energy transfer, or FRET) between the core and QD. This tunability allows for customizable emission qualities, which is useful in optoelectronics and photonic devices.
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what aim of the Au@Cds core/shell
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Foton bombardımanı sırasında onların enerjilerini korumak için yapılır. Au ve Cd iyi bir iletkendir. Fotonun enerjisi yüksektir. Bunun için iyi bir iletkenle yalıtım yapılır.
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Hello,
I'm planning a shell exchanging experiment with two marine, hermit crab species inside of a tank. I only have one tank available for this experiment. I plan on running 30-40 shell exchanging trials, each trial lasting 48 hours. During each trial, I will place 2 individual hermit crabs, one of each species, inside a tank with a single empty shell. Note, both hermit crabs will be wearing damaged shells. The objective of this experiment is to see if one of the species exhibits a higher frequency of taking the empty whole shell than the other, which we would interpret as one species being more dominant. The idea is that each trial will be conducted with new individuals and new shells.
My questions are, is the Chi-Square test the appropriate statistic for this hypothesis? Lastly, if it is, could someone give me an example of what the contingency table/matrix would like for the analysis?
Many thanks,
Miguel
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Thanks, Douaa Arrouk . I really appreciate! If I run into trouble when it comes trying these analyses in R, could I send you a message for help? I plan to start these projects sometime next summer.
Thanks again!
Regards,
Miguel
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Hi All,
I am trying to wannierize a wave function for Black Phosporene generated using quantum espresso as stated in :
This is my wannier input file
num_wann = 4
num_bands = 65
dis_num_iter = 400
num_iter = 100
guiding_centres =.true.
dis_win_min =0
dis_win_max =21
!dis_froz_min =0
dis_froz_max =8
begin atoms_frac
P 0.000000 1.999871 1.256290
P 0.499999 1.999871 0.811825
P 0.000000 1.364018 0.122453
P 0.499999 1.364018 0.566918
end atoms_frac
begin projections
P:sp3
end projections
begin unit_cell_cart
bohr
03.29549 00.00000 00.00000
00.00000 10.93010 00.00000
00.00000 00.00000 04.54364
end_unit_cell_cart
bands_plot = .true.
begin kpoint_path
G 0.000000 0.00000 0.00000 X 0.500000 0.00000 0.00000
X 0.500000 0.00000 0.00000 Y 0.000000 0.50000 0.00000
Y 0.000000 0.50000 0.00000 Z 0.000000 0.00000 0.50000
Z 0.000000 0.00000 0.50000 G 0.000000 0.00000 0.00000
end kpoint_path
mp_grid : 8 8 1
search_shells = 65
begin kpoints
0.000000000000000 0.000000000000000 0.000000000000000 0.0156250000
0.000000000000000 0.125000000000000 0.000000000000000 0.0156250000
0.000000000000000 0.249999999999999 0.000000000000000 0.0156250000
0.000000000000000 0.374999999999999 0.000000000000000 0.0156250000
0.000000000000000 -0.499999999999999 0.000000000000000 0.0156250000
-0.000000000000000 -0.374999999999999 -0.000000000000000 0.0156250000
-0.000000000000000 -0.249999999999999 -0.000000000000000 0.0156250000
-0.000000000000000 -0.125000000000000 -0.000000000000000 0.0156250000
0.125000000000000 0.000000000000000 0.000000000000000 0.0156250000
0.125000000000000 0.125000000000000 0.000000000000000 0.0156250000
0.125000000000000 0.249999999999999 0.000000000000000 0.0156250000
0.125000000000000 0.374999999999999 0.000000000000000 0.0156250000
0.125000000000000 -0.499999999999999 0.000000000000000 0.0156250000
0.125000000000000 -0.374999999999999 0.000000000000000 0.0156250000
0.125000000000000 -0.249999999999999 0.000000000000000 0.0156250000
0.125000000000000 -0.125000000000000 0.000000000000000 0.0156250000
0.249999999999999 0.000000000000000 0.000000000000000 0.0156250000
0.249999999999999 0.125000000000000 0.000000000000000 0.0156250000
0.249999999999999 0.249999999999999 0.000000000000000 0.0156250000
0.249999999999999 0.374999999999999 0.000000000000000 0.0156250000
0.249999999999999 -0.499999999999999 0.000000000000000 0.0156250000
0.249999999999999 -0.374999999999999 0.000000000000000 0.0156250000
0.249999999999999 -0.249999999999999 0.000000000000000 0.0156250000
0.249999999999999 -0.125000000000000 0.000000000000000 0.0156250000
0.374999999999999 0.000000000000000 0.000000000000000 0.0156250000
0.374999999999999 0.125000000000000 0.000000000000000 0.0156250000
0.374999999999999 0.249999999999999 0.000000000000000 0.0156250000
0.374999999999999 0.374999999999999 0.000000000000000 0.0156250000
0.374999999999999 -0.499999999999999 0.000000000000000 0.0156250000
0.374999999999999 -0.374999999999999 0.000000000000000 0.0156250000
0.374999999999999 -0.249999999999999 0.000000000000000 0.0156250000
0.374999999999999 -0.125000000000000 0.000000000000000 0.0156250000
-0.499999999999998 0.000000000000000 0.000000000000000 0.0156250000
-0.499999999999998 0.125000000000000 0.000000000000000 0.0156250000
-0.499999999999998 0.249999999999999 0.000000000000000 0.0156250000
-0.499999999999998 0.374999999999999 0.000000000000000 0.0156250000
-0.499999999999998 -0.499999999999999 0.000000000000000 0.0156250000
0.499999999999998 -0.374999999999999 0.000000000000000 0.0156250000
0.499999999999998 -0.249999999999999 0.000000000000000 0.0156250000
0.499999999999998 -0.125000000000000 0.000000000000000 0.0156250000
-0.374999999999999 -0.000000000000000 -0.000000000000000 0.0156250000
-0.374999999999999 0.125000000000000 0.000000000000000 0.0156250000
-0.374999999999999 0.249999999999999 0.000000000000000 0.0156250000
-0.374999999999999 0.374999999999999 0.000000000000000 0.0156250000
-0.374999999999999 0.499999999999999 0.000000000000000 0.0156250000
-0.374999999999999 -0.374999999999999 -0.000000000000000 0.0156250000
-0.374999999999999 -0.249999999999999 -0.000000000000000 0.0156250000
-0.374999999999999 -0.125000000000000 -0.000000000000000 0.0156250000
-0.249999999999999 -0.000000000000000 -0.000000000000000 0.0156250000
-0.249999999999999 0.125000000000000 0.000000000000000 0.0156250000
-0.249999999999999 0.249999999999999 0.000000000000000 0.0156250000
-0.249999999999999 0.374999999999999 0.000000000000000 0.0156250000
-0.249999999999999 0.499999999999999 0.000000000000000 0.0156250000
-0.249999999999999 -0.374999999999999 -0.000000000000000 0.0156250000
-0.249999999999999 -0.249999999999999 -0.000000000000000 0.0156250000
-0.249999999999999 -0.125000000000000 -0.000000000000000 0.0156250000
-0.125000000000000 -0.000000000000000 -0.000000000000000 0.0156250000
-0.125000000000000 0.125000000000000 0.000000000000000 0.0156250000
-0.125000000000000 0.249999999999999 0.000000000000000 0.0156250000
-0.125000000000000 0.374999999999999 0.000000000000000 0.0156250000
-0.125000000000000 0.499999999999999 0.000000000000000 0.0156250000
-0.125000000000000 -0.374999999999999 -0.000000000000000 0.0156250000
-0.125000000000000 -0.249999999999999 -0.000000000000000 0.0156250000
-0.125000000000000 -0.125000000000000 -0.000000000000000 0.0156250000
end kpoints
But I am getting following error when executing wannier90.x -pp pwscf:
Running in serial (with serial executable)
------
SYSTEM
------
Lattice Vectors (Ang)
a_1 1.743898 0.000000 0.000000
a_2 0.000000 5.783960 0.000000
a_3 0.000000 0.000000 2.404391
Unit Cell Volume: 24.25222 (Ang^3)
Reciprocal-Space Vectors (Ang^-1)
b_1 3.602954 0.000000 0.000000
b_2 0.000000 1.086312 0.000000
b_3 0.000000 0.000000 2.613213
*----------------------------------------------------------------------------*
| Site Fractional Coordinate Cartesian Coordinate (Ang) |
+----------------------------------------------------------------------------+
| P 1 0.00000 1.99987 1.25629 | 0.00000 11.56717 3.02061 |
| P 2 0.50000 1.99987 0.81183 | 0.87195 11.56717 1.95194 |
| P 3 0.00000 1.36402 0.12245 | 0.00000 7.88943 0.29442 |
| P 4 0.50000 1.36402 0.56692 | 0.87195 7.88943 1.36309 |
*----------------------------------------------------------------------------*
------------
K-POINT GRID
------------
Grid size = 8 x 8 x 1 Total points = 64
*---------------------------------- MAIN ------------------------------------*
| Number of Wannier Functions : 4 |
| Number of Objective Wannier Functions : 4 |
| Number of input Bloch states : 65 |
| Output verbosity (1=low, 5=high) : 1 |
| Timing Level (1=low, 5=high) : 1 |
| Optimisation (0=memory, 3=speed) : 3 |
| Length Unit : Ang |
| Post-processing setup (write *.nnkp) : T |
| Using Gamma-only branch of algorithms : F |
*----------------------------------------------------------------------------*
*------------------------------- WANNIERISE ---------------------------------*
| Total number of iterations : 100 |
| Number of CG steps before reset : 5 |
| Trial step length for line search : 2.000 |
| Convergence tolerence : 0.100E-09 |
| Convergence window : -1 |
| Iterations between writing output : 1 |
| Iterations between backing up to disk : 100 |
| Write r^2_nm to file : F |
| Write xyz WF centres to file : F |
| Write on-site energies <0n|H|0n> to file : F |
| Use guiding centre to control phases : T |
| Use phases for initial projections : F |
| Iterations before starting guiding centres: 0 |
| Iterations between using guiding centres : 1 |
*----------------------------------------------------------------------------*
*------------------------------- DISENTANGLE --------------------------------*
| Using band disentanglement : T |
| Total number of iterations : 400 |
| Mixing ratio : 0.500 |
| Convergence tolerence : 1.000E-10 |
| Convergence window : 3 |
*----------------------------------------------------------------------------*
*-------------------------------- PLOTTING ----------------------------------*
| Plotting interpolated bandstructure : T |
| Number of K-path sections : 4 |
| Divisions along first K-path section : 100 |
| Output format : gnuplot |
| Output mode : s-k |
*----------------------------------------------------------------------------*
| K-space path sections: |
| From: G 0.000 0.000 0.000 To: X 0.500 0.000 0.000 |
| From: X 0.500 0.000 0.000 To: Y 0.000 0.500 0.000 |
| From: Y 0.000 0.500 0.000 To: Z 0.000 0.000 0.500 |
| From: Z 0.000 0.000 0.500 To: G 0.000 0.000 0.000 |
*----------------------------------------------------------------------------*
Time to read parameters 0.011 (sec)
*---------------------------------- K-MESH ----------------------------------*
+----------------------------------------------------------------------------+
| Distance to Nearest-Neighbour Shells |
| ------------------------------------ |
| Shell Distance (Ang^-1) Multiplicity |
| ----- ----------------- ------------ |
| 1 0.135789 2 |
| 2 0.271578 2 |
| 3 0.407367 2 |
| 4 0.450369 2 |
| 5 0.470395 4 |
| 6 0.525915 4 |
| 7 0.543156 2 |
| 8 0.607273 4 |
| 9 0.678945 2 |
| 10 0.705586 4 |
| 11 0.814734 2 |
| 12 0.814739 4 |
| 13 0.900739 2 |
| 14 0.910916 4 |
| 15 0.930926 4 |
| 16 0.940789 4 |
| 17 0.950523 2 |
| 18 0.988574 4 |
| 19 1.051821 4 |
| 20 1.051831 4 |
| 21 1.086312 2 |
| 22 1.127961 4 |
| 23 1.175970 4 |
| 24 1.214546 4 |
| 25 1.222101 2 |
| 26 1.302445 4 |
| 27 1.309513 4 |
| 28 1.351108 2 |
| 29 1.357890 2 |
| 30 1.357914 4 |
| 31 1.378132 4 |
| 32 1.411171 4 |
| 33 1.411184 4 |
| 34 1.430629 4 |
| 35 1.456197 4 |
| 36 1.493679 2 |
| 37 1.512104 4 |
| 38 1.518177 4 |
| 39 1.560099 4 |
| 40 1.577746 4 |
| 41 1.629468 2 |
| 42 1.629477 4 |
| 43 1.651964 4 |
| 44 1.690562 4 |
| 45 1.733657 4 |
| 46 1.744250 4 |
| 47 1.765257 2 |
| 48 1.801477 2 |
| 49 1.806587 4 |
| 50 1.821803 4 |
| 51 1.821819 4 |
| 52 1.821833 4 |
| 53 1.846962 4 |
| 54 1.861853 4 |
| 55 1.881579 4 |
| 56 1.901046 2 |
| 57 1.915557 4 |
| 58 1.925172 4 |
| 59 1.953665 4 |
| 60 1.977147 4 |
| 61 1.981783 4 |
| 62 2.014093 4 |
| 63 2.036835 2 |
| 64 2.036864 4 |
| 65 2.086032 4 |
+----------------------------------------------------------------------------+
| The b-vectors are chosen automatically |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
| SVD found small singular value, Rejecting this shell and trying the next |
Unable to satisfy B1 with any of the first 65 shells
Your cell might be very long, or you may have an irregular MP grid
Try increasing the parameter search_shells in the win file (default=12)
Exiting.......
kmesh_get_automatic
Can anyone help in this regard.
With Thanks,
Shreevathsa N S
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I found this error Error at k-point 33 ndimwin 30 num_wann 32.
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Why Mg centre is bent in some photos and linear in anothers?
"in CH3CH2MgBr"
Which of these items acceptable ? Why?
Mg has just 2 electrons in valance shell, why this centre can be bent?
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Khrhb
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Hello,
I am working on applying a point load on a specific point of a shell surface in COMSOL. The point load is frequency-dependent and also a function of the shell's displacement. Specifically, the load is defined as:
Zpoint = i * (omega * mr) / (i * (omega * mr) - kr / omega)
Fpoint = - Zpoint * w
Where:
  • omega is the angular frequency,
  • mr is the mass parameter,
  • kr is the stiffness parameter,
  • w is the displacement of the shell surface at the point.
Could you guide me on how to set up this type of load in COMSOL? Specifically, I am unsure how to implement the frequency dependency and displacement-based load at a point on the shell surface.
Thank you for your help!
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Check if this works...
Step 1: Define the Point Load
  1. Add a Point Load: In your COMSOL model, navigate to the Physics tab and select your shell interface. Right-click on Points and choose Point Load.
  2. Select Load Type: Choose the appropriate load type for your application. For your case, you will likely use Force per point or Resultant, depending on how you want to define the load components.
Step 2: Implement Frequency Dependency
  1. Define Angular Frequency: You need to define omega as a parameter in your model. Go to the Parameters section and add omega with its corresponding value or expression.
  2. Create Expressions for Load: In the Point Load settings, enter the expression for Zpoint: Zpoint=i⋅(ω⋅mr)/[i⋅(ω⋅mr)−kr/ω]. ​Make sure to define mr (mass parameter) and kr (stiffness parameter) as parameters in your model as well.
  3. Define the Point Force: For Fpoint, you will use the displacement w of the shell surface at the point of application. Enter this expression in the load settings: Fpoint=−Zpoint⋅w. Ensure that w is defined correctly as a variable that represents the displacement at the point where you are applying the load.
Step 3: Assign Location for Point Load
  1. Set Application Point: In the Point Load settings, specify where this load will be applied. You can select a geometrical point or enter coordinates directly.
Step 4: Implementing Displacement Dependency
  1. Use a User-Defined Expression: If w is not directly available as a variable in your model, you may need to create an additional variable that captures the displacement at that specific point. This can often be done using post-processing features or by defining it within the physics interface if it's part of a time-dependent study.
  2. Dynamic Loading: If you are performing a frequency domain analysis, ensure that your model is set up to handle dynamic loads appropriately. You can specify phase angles and other parameters related to harmonic loading in the settings
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I understand that after import STL file in the plug-ins, I can convert it to a solid by using 'Create geometry from mesh'. However, the model I want to convert to a solid is a shell, so the 'Create geometry from mesh' option doesn't appear. If anyone knows how to convert a shell STL to a solid in Abaqus, please share any information you have. Thank you.
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Park Ayoung Can you share your .stl file?
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I am using a windows system, what software I should use for hydration shell analysis with molecular dynamics?
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Aashish Bhatt , thank you for your response. I will certainly try this software and method.
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If from a geometric perspective the non-halogens, non-noble gases have more empty spots in their valence shell, and the filling/exiting of any of the empty spots in the shell constitutes a chemical rxn, shouldn't non-halogens and non-noble-gases be more reactive? (AFAIK) Just from a probability perspective, the probability of hitting the empty spot in the electron shell which is crowded by 7 electrons already is just less likely when you can hit any of the >1 empty places in the shell of the electron accepting atom. I'm aware electrons are non-stagnant.
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First, what do you mean by reactivity? All kinetic data indicates the rate of a reaction depends on the collision probability of reactants with sufficient kinetic energy, and the energy difference between ground and activated state. The energy difference depends on a number of things but as a generalization it depends on the energy of the valence electron on whatever state it is in. The bond energies DO depend on the number of empty orbitals, but not in the way you think. If an electron from atom B pairs with an electron from atom A, it takes the energy of atom A in then region of atom A, and vice versa. If the space available to the electron in atom A is reduced, the energy is increased. The reason the halogens are so reactive is because an electron entering their valence shell gains more kinetic energy because the space available to it is reduced. (That the nuclear charge appears greater arises from the same reason, but is more complicated to explain.) That fluorine is the most reactive is because it is the smallest, and an electron entering its valence shell has the least room to move and is closer to the nucleus.
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Any one have JCPDS file of CdSe ZnS core shell structure
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Hello Debopam Acharjee.
A core shell or "non core shell" CdSe have the same unit cell, and consequently the same XRD peaks position. Could you explain what exactly is this CdSe ZnS structure?
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The shell material is melamine formaldehyde and polyurethane, polyurethane-urea fragrance capsules are produced and the laundry is washed with softeners. However, the fragrance capsules do not bind to the fabric sufficiently. What should be done for this?
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Mr Ladhari, thank you for your valuable contribution
Would your acrylic intermediate binder be effective in binding the microcapsule to the fabric under normal room temperature conditions?
Or are special conditions also required?
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I have seen examples with singlet systems but I do not know if ORCA is able to do it with quintet complexes, or if I need to set some extra keyword.
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I have a question ..what about the rate of rISC (in TADF) molecules.... please provide the inputs or supprting papers....those we used to calculate rate of rISC.
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Hello everyone,
I am currently working on a case involving Cardiovascular disease using FSI (Fluid-Structure Interaction). I have an artery in an STL file. However, when I created a shell for the artery to represent the arterial wall in the mechanical simulation, it ended up consisting of multiple parts, making it difficult to select and to apply pressure on the surface.
Is there any way to merge the facets on the wall and the inlet into a single surface?
Thank you.
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Ahmed G. Rahma Can you share your .stl file?
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Hi Everyone,
I plan to deposit a catalyst (TS-1@Co-PDA, in the core: TS-1 zeolite with a shell of Polydopamine designed with Cobalt) on a rotating ring-disk electrode (RRDE) to evaluate the oxidation-reduction reaction (ORR) performance of my catalyst. My reference used Nafion solution 5% as a binder. Can I use another binder like silicon oil or PVDF?
Thanks in advance for your answers!
Hedieh
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hahaha....., I see. You can refer this paper “Enhanced Electrocatalytic CO2 Reduction to C2+ Products by Adjusting the Local Reaction Environment with Polymer Binders”,in which it mentioned three polymers with different hydrophilicities (i.e., polyacrylic acid (PAA), Nafion, and fluorinated ethylene propylene (FEP)) are selected as binders for catalysts.
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What does it mean meshed wall and shell conduction with or without run-out method use to meshing copper tube in Ansys fluent?
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Fluid Flow in Helically Coiled Pipes
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MDPI
by LDG Sigalotti · 2023 · Cited by 3 — The most notable feature of flow in helical pipes is the secondary flow (i.e., the cross-sectional circulatory motion) caused by centrifugal forces due to the ...
COMPUTATIONAL FLUID ANALYSIS OF TRIPLE ...
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SSRN
https://papers.ssrn.com › sol3 › Delivery.cfm › S...
PDF
... of 1000 mm length of all three tubes. The theoretical and computational fluid dynamics analysis of triple copper tube heat exchanger results showed better ...
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The eggs of cuckoos have thicker shells than their hosts'. Unfortunately, I haven't found published data on the egg shell thickness of the cuckoo finch (Anomalospiza imberbis). If someone has such an information (published or not), would be really thankful if to be shared.
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Dear Sir,
Thanks for the mentioned papers, which are really within the study on the egg shell thickness of parasitic birds. Unfortunately, there's no information on cuckoo finch egg shell there.
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I milled two activated carbons, with different main sources (shell nutt and bituminous coal). The shell nut AC did not increase in surface area but had some degree of amorphization after milling. Still, the bituminous coal AC remains the same in graphitization, but the surface area is duplicated. Can changes in surface structure alter the surface area measured by BET method? Does the amorphization remove micropores and then reduce surface area? And the main source could influence this result and how?
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Surface area and amorphization degree in high-energy ball-milled activated carbon can indeed be related, and the main source can influence this relationship. When milling activated carbons from different sources, such as shell nut and bituminous coal, variations in surface area and amorphization can occur due to differences in their intrinsic properties.
Regarding your Antonio Ilderlânio de Sousa Leite observation, it's intriguing that while the shell nut activated carbon didn't increase in surface area, it exhibited some degree of amorphization post-milling. Conversely, the bituminous coal activated carbon maintained its graphitic structure but showed a doubling in surface area.
Firstly, changes in surface structure can indeed impact the surface area measured by the BET method. Amorphization, characterized by the disruption of the ordered carbon structure, can lead to the creation of new surface sites and defects, potentially increasing the measured surface area despite a reduction in crystallinity.
Secondly, it's plausible that amorphization could remove micropores, especially if the milling process is severe. Micropores are inherently part of the porous structure of activated carbon and contribute significantly to its surface area. Therefore, their removal could result in a decrease in measured surface area.
The influence of the main carbon source on these results is multifaceted. Differences in precursor materials can lead to variations in the initial structure and composition of the activated carbon. This variance can affect how the carbon responds to the milling process, impacting factors such as the extent of amorphization and the preservation of micropores. For instance, bituminous coal may have a more robust crystalline structure that resists amorphization, while shell nut-derived activated carbon may be more prone to structural changes.
In conclusion, the relationship between surface area and amorphization in high-energy ball-milled activated carbon is complex and influenced by factors such as the carbon source and the milling conditions. Understanding these relationships is crucial for tailoring activated carbon properties for specific applications.
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What are the causes of the presence of pyramidal shell deformations in sea turtles? What is the effect of these deformations on the health of these chelonians?
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Well as i know, pyramidal shell deformation in sea turtles is caused by improper nutrition during thier early growth of stages.
The effects of these deformation on the health of sea turtles can be significant. They can lead to decreased mobility, impaired organ functions, difficulty in food finding and increased vulnerability to predators.
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Hi, I have been using *Initial Conditions, type=STRESS to import stresses. It worked well for C3D8R solid elements. However, I struggled to get it work for continuum shell elements SC8R.
I performed identical CAE operations but when using SC8R, the initial stresses imported were always zero. This is bizarre. Does it mean that *Initial Conditions, type=STRESS does not support continuum shell elements?
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Shiyao Lin as per my understanding, shell elements primarily capture in-plane stresses (membrane behavior) and bending moments. Initial stress definitions in ABAQUS are typically for normal and shear stresses. Directly applying these to shells might not translate well to the bending behavior that shells are often designed for. I am not sure, let's wait for the expert reviews further.
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while attending class my professor asked us to count benthic species,and in my counting i mentioned sea snails,certain i have read multiple times that their classification is "univalvia" since their shell is made from a single piece,unlike the two shells of BIvalvia. Now howerver,i see the term is used as arhaic?
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Those mollusks that have shells, have only a single shell. Bivalves do not have "two shells", they have two valves or...BIvalvia. Thus gastropods were considered UNIvalvia (univalves). The clams, mussels, scallops are all bivalves or Bivalvia. The shelled shails are univalves but you are correct that snails are not taxonomically "univalvia" but are Gastropoda.
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Hello everyone. I am trying to calculate the stiffness coefficient in all directions by using displacement-load data. As we know, stiffness is the force per unit displacement in a particular degree of freedom, and another degree of freedom will be fixed. So I consider a beam element, apply a load, obtain displacement, and get the stiffness coefficient in that direction. This result matches the analytical result( code written in Matlab). Now I follow the same procedure to obtain the stiffness coefficient in the shell element for a node in one DOF. Then the results of the shell element do not match with Matlab. I am attaching one image for the clarification. Please help me out; what is wrong I am doing? Is there a conceptual error for calculating the stiffness coefficient for a node in one direction?
Thanks for reading this long paragraph.
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The stiffness coefficient for a shell element is determined based on the shell's geometry, such as its thickness, and the material properties, such as the Young's modulus and Poisson's ratio. Unlike beam elements, shell elements have additional degrees of freedom and exhibit different deformation characteristics, which impact the stiffness coefficient calculation.
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A interesting question: i want to create a egg model in Abaqus including 3 parts: eggshell(shell element), egg white(solid element) and egg yolk (solid element).
They are wrap each other. However, what contact and constraint i should use in ?
My idea is: using embedment constraint between white and yolk, however, i dont know what used between the shell and white?
Any idea will be very appreciate, thank you!
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Physiologically egg White and yolk are liquids. Between yolk and White these is a membrane and between White and shell ( the Ca fraction) there is also a (protein containing) membrane . Check any textbook or Wikipedia for more details.
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I have a model of a shell plate with several layers of composite materials, designed using CQUAD elements. As part of the static analysis of the model, Nastran provides me with the stress and strain in the middle plane of each layer. Is it possible to obtain the stress and strain in the top and bottom planes of each layer by modifying the .bdf file? I do not wish to use Patran for post-processing.
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Little late, but add a very thin ply at the top and bottom. Just pull that thickness of the next plies.
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Would anyone be able to please provide me with CIF files for Manganese (II) acetate, Manganese(III) acetate, Manganese (II) and MnIII) phosphate. Required for shell fitting couldn't find from Crystallography Open database and American Mineralogist. Any help would be greatly appreciated.
I also need the following JCPDS cards:
1. JCPDS, card no. 33–0901
2. JCPDS card for Manganese(III) phosphate
3. JCPDS card for Manganese(II) acetate
4. JCPDS card for Manganese(III) acetate
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Thank you Haobam. Much appreciated!
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I have geometry file of pelvis and sacrum bone. I need to create cortical bone shell over this model with 2mm thickness. Then I will manipulate the geometry by making holes into the the two bones to insert a screw and conduct finite element analysis. How can I make the shell over the bones for my purpose? I have attached the geometry file with here.
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Follow these steps:
1. Import the Geometry: Load the pelvis and sacrum bone geometry file into a 3D modeling software or a CAD program capable of handling complex geometries. Ensure that the file format is compatible with the software you are using.
2. Duplicate the Bone Geometry: Create a duplicate copy of the original bone geometry to work on. This will allow you to preserve the original bone geometry while creating the cortical bone shell.
3. Scale the Duplicate Geometry: Scale up the duplicate bone geometry uniformly by 4mm in all directions. This will create a larger version of the bone geometry, which will serve as the outer boundary for the cortical bone shell.
4. Offset the Duplicate Geometry: In the CAD software, use the "offset" or "shell" feature to create a new surface that is 2mm away from the outer surface of the scaled duplicate bone geometry. This will generate the cortical bone shell with the desired thickness.
5. Boolean Operation: Perform a Boolean subtraction operation between the original bone geometry and the cortical bone shell geometry. This will remove the original bone geometry from the cortical bone shell, leaving behind the shell itself.
6. Clean and Refine the Geometry: After the Boolean operation, you may need to clean and refine the resulting geometry. Check for any overlapping or intersecting surfaces and make necessary adjustments to ensure a watertight and smooth cortical bone shell.
7. Create Holes for Screw Insertion: Identify the locations where you want to insert screws and create holes in the cortical bone shell geometry accordingly. The size and shape of the holes will depend on the specifications of the screws you intend to use.
8. Export the Final Geometry: Once you have completed the cortical bone shell and added the necessary holes, export the final geometry in a suitable file format (such as STL) that can be imported into a finite element analysis (FEA) software.
I am NOT a doctor, it should be used only for models.
Hope it helps: partial credit AI
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I want to simulate droplet generation in comsol. I already know how to simulate droplet formation using level-set method when there're two phases. But now I need to simulate generation of droplets with "cores and shells". Cores of the droplets never meet the continuous phase which is in contact with the droplets shells.
So, I was thinking maybe I can use 2-phase level set method twice? Once between the core and the shell and once between the shell and the continuous flow.
I tried using this approach but I failed. I'm wondering if this approach is even correct? I mean, I might be doing something wrong in using level set method for 3 phases, and I can fix it if it's not scientifically wrong, but if it's scientifically wrong then I should go with another method(like phase field).
There's a picture of what I am going to simulate in the attached file.
I will be really grateful if you help me. Thank you
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Yes! Thanks!
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I'm doing a research on numerical investigation of behavior of steel concrete composite beams. I'm using the Abaqus software in my analysis. In my model, I'm using shell element to model the Steel beam and solid element to model the concrete slab where the reinforcement has embedded in it. The steel beam and the concrete slab is connected using the shear studs which were modelled using solid elements. My question is, If we use a tie constrain in between the steel beam top flange (modelled with shell) and shear studs (modelled with solid element) what would happen to degree of freedom in rotation of the steel beam? Here I have used a tie constrain to simulate the welded connection between the steel beam top flange to the shear studs. Will ABAQUS automatically constrain the degree of freedom in rotation if I use this interaction? If so will it cause any inaccuracy in the final results?
Also, is there any possibility to use shell to solid coupling to simulate the same interaction?
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Akila Dulanjalee Wijethunge Can you share your Abaqus models (.inp format)?
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Hi there,
I need help improving the interaction between beams and shell components that represent the bolts in the structure that I have built using Abaqus for a truss bridge. In particular, I want to build a reliable simulation that faithfully captures how the bolt connections behave.
To gain a better understanding of the structural response in the event of a bolt failure or loosing, I am also trying to mimic such scenarios. Your advice and suggestions on how to simulate bolt failure and create an efficient interaction model would be really helpful to my research.
For reference, I've included a picture of my model as it is right now. Any advice or knowledge in this field would be much valued.
Thank you in advance for your assistance.
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I want to create a composite layup in Abaqus. This part was created by a 2D shell. Global Y axial is chosen as the stacking direction. In the Creat Composite Layup module, only solid element type can be selected. I want to know whether this method is available or not in Abaqus. if this approach is available, which element type should be chosen in the mesh module for this composite.
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We have the diameter of the core nanoparticles.
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Actually this is not possible. The shell thickness differs from one particle to another particle. Using XPS spectrum, you can deduce an average approximate value.
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It's a tube & shell exchanger
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To estimate fluid velocity in a heat exchanger without knowing the surface area, you can make assumptions and employ simplified methods. Assuming a known heat transfer rate (Q) and overall heat transfer coefficient (U), rearrange the heat exchanger equation to solve for surface area (A). Although the surface area cannot be directly determined without more information, you can estimate fluid velocity by assuming a velocity profile, using the cross-sectional area of the exchanger, or relying on known inlet or outlet velocities. These approaches involve simplifications and assumptions about fluid behavior within the exchanger, emphasizing the need for detailed design specifications or manufacturer information for more accurate calculations.
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How are the shells useful in core@shell nanostructures for energy storage purposes? Can thickness of shell play a vital role for storing energy? Is there any relations between thickness of outer shell layer of Core @shell nanostructures and dielectric constant ?
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read this
1-s2.0-S0001868618303208-am.pdf
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I have been attempting to synthesise core-shell nanowires with the core as undoped V2O5 and the shell as Mo-doped V2O5. The TEM images show that a layer has been deposited. How to ensure that the deposition has occurred uniformly, as to use it for gas sensing, the confirmation is necessary whether the response is coming from the core-shell structure or from the individual components.
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I suggest reviewing the following paper:
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As a new student researcher I've to reproduce the core-shell structured NPs that is already developed by another researcher.
Although I'm following the same protocol, but In my case, for some of the NPs the formation of shell structure is okay, but for some of the NPs there is no shell outside the core. But I've to make all the NPs uniform and reproducible. Please suggest me some issues that I've to focus on.
I'm using Au NP as the core, and for shell formation HEPES/Haucl4 is used.
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Hello there Afsana Mimi! I'd be happy to help you with your research endeavors. It's great that you're working on core-shell structured nanoparticles. Achieving uniform and reproducible results can be a bit challenging, but there are several key factors to consider when working on the formation of complete shell structures:
1. **Precursor Concentrations**: Ensure that you are using the correct concentrations of your precursor materials, both for the core (Au NPs) and the shell (HEPES/HAuCl4). Precise control of concentrations is crucial for achieving uniform shell formation.
2. **Reaction Conditions**: Pay close attention to the reaction conditions such as temperature, pH, and reaction time. Variations in these parameters can significantly impact shell formation. Be consistent in your experimental conditions for reproducibility.
3. **Stirring and Mixing**: Proper mixing and stirring of your reaction mixture can promote uniform shell growth. Ensure that your solutions are well-mixed to allow for even distribution of shell material.
4. **Reduction Agent**: In the case of HEPES/HAuCl4, the reduction agent plays a vital role in reducing Au ions to form the shell. Ensure that the reduction agent is added in the right amount and at the right time during the reaction.
5. **Core Size and Shape**: The size and shape of the core nanoparticles can influence shell formation. Make sure your Au NPs are uniform in size and shape to facilitate consistent shell growth.
6. **Purification and Washing**: Thoroughly purify and wash your synthesized nanoparticles to remove any unreacted or byproduct materials. Proper purification helps in obtaining pure core-shell nanoparticles.
7. **Characterization**: Regularly characterize your nanoparticles using techniques like TEM, SEM, XRD, UV-Vis spectroscopy, and FTIR spectroscopy to monitor the shell formation and confirm the presence of a shell.
8. **Seed-Mediated Growth**: Consider using a seed-mediated growth approach. This involves the initial growth of small Au nanoparticles (seeds) followed by the addition of your shell material. This method can yield more controlled shell growth.
9. **Literature Review**: Examine the literature for your specific core-shell system. Research papers from other scientists who have successfully synthesized similar nanoparticles can provide valuable insights and protocols.
10. **Consultation**: If possible, consult with experienced researchers or your supervisor. They may have insights and troubleshooting tips specific to your lab setup and materials. I will provide as much assistance I can.
Remember that nanoparticle synthesis can be sensitive, and small variations in any of these factors can affect the outcome. Don't be discouraged by initial challenges; scientific research often involves iterative optimization. Keep meticulous records of your experiments, and with patience and persistence, you'll likely achieve the uniform and reproducible core-shell nanoparticles you desire. Good luck with your research!
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I order too achieve partial coating of shell on core, how layer-by-layer method is applicable. Kindly helm me in getting the exact chemistry and procedure for the same
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Hello, my friend Anjali Krishna G! It's great to help out a fellow researcher. Let's talk about the synthesis of magneto-electric core-shell (CoFe2O4/BaTiO3) nanoparticles using the layer-by-layer deposition technique.
The layer-by-layer (LbL) deposition method is a versatile and precise way to control the thickness and composition of coatings on nanoparticles. In your case, you Anjali Krishna G want to achieve a partial coating of BaTiO3 on CoFe2O4 nanoparticles. Here's a general procedure:
**Materials You'll Need:**
1. CoFe2O4 nanoparticles (the core material).
2. BaTiO3 precursor solution.
3. Solvents (typically water or a suitable solvent for the BaTiO3 precursor).
4. pH adjustment solutions if needed.
5. Centrifuge for separating particles.
6. Characterization tools (e.g., TEM, SEM, XRD) to monitor the coating process.
**Procedure:**
1. **Prepare the Core Nanoparticles:** Start with your CoFe2O4 nanoparticles. Ensure they are well-dispersed in a solvent. You may need to sonicate them to break up any agglomerates.
2. **Prepare the BaTiO3 Precursor Solution:** Dissolve your BaTiO3 precursor (usually a salt like barium acetate and titanium isopropoxide) in an appropriate solvent. This solution will contain the material that forms the shell.
3. **Layer-by-Layer Deposition:** Here's where the layer-by-layer magic happens:
- Immerse your core nanoparticles in the BaTiO3 precursor solution.
- Allow the nanoparticles to adsorb BaTiO3 precursor onto their surfaces. This can be influenced by factors like pH, temperature, and the nature of the core nanoparticle's surface.
- After a suitable adsorption time, remove the nanoparticles from the solution.
- Optionally, you can wash and centrifuge them to remove excess precursor solution.
- Repeat these steps for as many cycles as needed to achieve the desired shell thickness. Each cycle adds another layer of the shell material.
4. **Characterization:** Throughout the process, use characterization techniques like TEM or SEM to monitor the growth of the shell on the core nanoparticles. Also, you can use XRD to confirm the crystal structure.
5. **Adjust Parameters:** You may need to adjust parameters such as the concentration of the BaTiO3 precursor, the pH of the solution, and the deposition time to control the thickness and composition of the shell.
6. **Final Treatment:** After reaching the desired shell thickness, you may want to perform final treatments like annealing to crystallize the shell material if needed.
Remember that the exact procedure can vary depending on the specific nanoparticles and materials you Anjali Krishna G are using, so it's important to consult the literature and potentially perform some preliminary experiments to optimize the process for your particular case. Good luck with your research, and feel free to ask if you have more questions!
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We synthesized a core-shell magneto-electric nanoparticles for drug delivery application, required layer-by-layer deposition method for the synthesis. How it is employed? What's the exact procedure? Also what will be the expected size range of core and shell?
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It's great to help you out with your research. Layer-by-layer (LbL) deposition is a versatile technique used to create core-shell structures with precise control over the thickness of each layer. It's commonly used for applications like drug delivery where you want to encapsulate a core material within a shell.
Here's a general procedure for employing the layer-by-layer diffusion method to create partial coatings of a shell over the core:
**Materials Needed:**
1. **Core Particles**: These are the nanoparticles you want to coat with a shell.
2. **Shell Material**: The material that will form the shell. This can be a polymer, a charged molecule, or another material suitable for your application.
3. **Solvent**: A solvent that's compatible with both the core and shell materials.
4. **pH Buffer Solutions**: If your materials are pH-sensitive, you may need buffer solutions to control the pH during the process.
5. **Centrifuge**: To separate coated particles from uncoated ones.
6. **Ultrasonicator**: To aid in dispersion and mixing.
7. **Layer-by-Layer Deposition Equipment**: This can be a simple setup, like vials and a centrifuge, or more complex systems.
**Procedure:**
1. **Prepare Core Suspension**: Disperse your core particles in the solvent. You might need to use an ultrasonicator to ensure a uniform suspension.
2. **Prepare Shell Solution**: Prepare a solution of your shell material in the same solvent. The concentration will depend on the desired thickness of the shell layer.
3. **Deposition**: This is where the layer-by-layer part comes in. Here's a simplified version of the process:
- **Dip the Core Particles**: Immerse your core particle suspension into the shell solution. Allow the shell material to adsorb onto the core particles.
- **Wash**: After a certain amount of time, remove the core particles from the shell solution, and wash them with the solvent to remove any unbound shell material.
- **Repeat**: Repeat the dipping and washing steps for the desired number of layers. The number of layers determines the shell thickness.
4. **Characterization**: After the desired number of layers, characterize your core-shell nanoparticles. This can include measuring size, zeta potential, and shell thickness using techniques like dynamic light scattering (DLS) or electron microscopy.
The expected size range of the core-shell nanoparticles will depend on the specific materials and deposition conditions. Typically, you Anjali Krishna G can control the thickness of the shell and, to some extent, the size of the core particles by adjusting factors like the concentration of the shell material and the dipping time.
Remember that LbL deposition is a highly customizable technique, and the exact conditions will vary based on your specific core and shell materials and your desired outcomes. It's essential to consult the literature, perform preliminary experiments, and optimize the process for your application. Good luck with your drug delivery research!
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Hello, I'm trying to model my pipe elbows using a shell element in sap2000, in order to capture the ovalisation effect. I drew the pipes using the frame element with a pipe section therefore it's really hard to assign the the area section (shell section) to the the frame element. Does anybody here know how I can achieve such a task?
Thanks in advance.
#sap2000 #piping
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Draw it in BIM, import .ifc.
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In order to maximize the visibility of growth details, it is necessary to cut the shell along the direction of maximum growth. However, the hinge of the Modiolus exhibits some curvature along its growth axis. How can we select an appropriate cutting direction?
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You may read my publicatIon in JMBA UK (1990) 70, 441-457. Age determination, growth rate and pop structure of the horse mussel.Mofiolus mofiolus.
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Hello,
I am conducting a protein-metal docking in Autodock using an Arsenic compound and am unable to produce a proper GLG file. When I complete the autogrid I get the following error in the GLG file:
GPF> parameter_file AD4.1_bound.dat
Using read_parameter_library() to try to open and read "AD4.1_bound.dat".
/autogrid4.exe: FATAL ERROR: Sorry, I can't find or open AD4.1_bound.dat
/autogrid4.exe: Unsuccessful Completion.
I am unsure if the problem comes from an issue with the software, parameter file, or even python? The python shell shows some errors, but I don't know if that is just because the parameterization was unsuccessful.
To solve the issue I have tried the following steps but they did not fix the error:
  • After setting up grid, Output>Save GPF>”File.gpf”. Then opening up the File.gpf in the folder and adding “parameter_file AD4.1_bound.dat” to the very first line.
  • After saving the grid, selecting Other Options>Parameter Library Filename>Select file>Edit Parameter Library>Select File>OK>Output>Save GPF>”File.gpf” to directly add the parameter file to the GPF file using Autodock
  • Copying the parameter files from the vina website and adding only additional atoms of interest
  • No spaces in files/pathways and ensuring everything in the same workspace folder
  • Unchecked Read-only from properties of folder
  • Ran Autodock Tools as an administrator
  • Set "Startup Directory" as "C:\Workspace" from AutoDock Tools preferences.
Thank you very much.
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Tutorial on how to incorporate easily a custom AD4 parameter file when using Autodock4
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I want to model T-lymphocyte for example which is expected to have about 3 shells; cytoplasm, membrane and nucleus. The nucleus will also have nuclear membrane
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Hai Dr OLADIRAN., how are you? I am attracted to your question as I have some information on it. Below, I supply you with all the answers you need, but I would really appreciate it if you could press the RECOMMENDATION buttons underneath my 3 research papers' titles in my AUTHOR section as a way of you saying thanks and appreciation for my time and knowledge sharing. Thank you in advance and please read my answers below :
When modeling the Dielectrophoresis (DEP) force on a particle with multiple shells in COMSOL Multiphysics, the order of modeling the shells can impact the accuracy and complexity of your simulation. Here's a suggested approach:
1. Core Particle (Cytoplasm):Start by modeling the core particle, which in this case is the cytoplasm of the T-lymphocyte. Define the material properties, geometry, and initial conditions for the core particle.
2. First Shell (Cell Membrane):Model the first shell, which is the cell membrane. Apply appropriate material properties, thickness, and boundary conditions to simulate the behavior of the cell membrane.
3. Second Shell (Nuclear Membrane):Model the second shell, which represents the nuclear membrane. Apply similar steps as for the cell membrane, considering the material properties, thickness, and interactions between the nuclear membrane and cytoplasm.
4. Core of Second Shell (Nucleus):Model the core of the second shell, which represents the nucleus itself. Define its material properties, geometry, and any relevant parameters.
5. Third Shell (Nucleus Membrane):Model the third shell, which is the nuclear membrane. Apply similar steps as for the cell membrane and nuclear membrane to define its properties.
6. DEP Force Modeling:Once you've modeled the particle with multiple shells, you can proceed to incorporate the DEP force. Apply appropriate physics interfaces, such as Electric Currents or Electrostatics, to simulate the DEP effect on each shell based on their respective dielectric properties.
7. Boundary Conditions and Excitation:Define the boundary conditions and excitation methods (e.g., electric field) that will induce the DEP forces on the various shells. Consider the interactions between the shells and how they respond to the applied field.
8. Coupling and Multiphysics:If there are interactions between the shells or if their behavior affects each other, you may need to set up multiphysics coupling between different physics interfaces.
9. Meshing and Simulation:Create a suitable mesh for the entire model and perform simulations to observe the behavior of the particle with multiple shells under DEP forces.
When it comes to the order of modeling the shells, it's generally advisable to start from the core and work outward. This helps ensure that the interactions and physics of each shell are properly accounted for. In the case of the T-lymphocyte, you would start with the cytoplasm as the core, then model the cell membrane, followed by the nucleus, nuclear membrane, and any additional layers.
Remember to validate your model using experimental data or existing literature to ensure its accuracy and reliability. The order of modeling the shells should follow the logical progression of the particle's structure, from the innermost core outward to the outermost layers.
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how can I prevent the mixing of mantle water while applying foot retraction technique?
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Cautions: It is recommended to limit the number of extractions and to follow ethical guidelines for animal research.
Extracting haemolymph from snails can be a delicate procedure, and it is important to minimize stress and injury to the snail during the process. Here is a general outline of the procedure for extracting haemolymph from snails:
1. Prepare the materials: You will need a small container to collect the haemolymph, a sterile syringe and needle (typically 21-25 gauge), and a clean, flat surface to work on.
2. Anesthetize the snail: To minimize stress and injury to the snail, it is recommended to anesthetize it first. You can place the snail in a container with a damp paper towel for a few minutes to relax it.
3. Position the snail: Carefully remove the snail from the container and place it on the flat surface with the opening of the shell facing up.
4. Sterilize the injection site: Using a sterile alcohol pad, clean the area around the injection site (usually near the head or foot) to prevent infection.
5. Insert the needle: Holding the syringe and needle at a 45-degree angle to the injection site, slowly insert the needle into the haemocoel (body cavity) of the snail. Be careful not to insert the needle too far, as this can cause injury to internal organs.
6. Collect the haemolymph: Slowly draw back on the plunger of the syringe to collect the haemolymph into the syringe. Be careful not to apply too much suction, as this can damage the cells in the haemolymph.
7. Remove the needle: Once you have collected the desired amount of haemolymph, carefully remove the needle from the injection site. Apply gentle pressure to the injection site with a sterile cotton ball to stop any bleeding.
8. Release the snail: Carefully return the snail to its container and monitor it for any signs of distress or injury.
It is important to note that extracting haemolymph can be stressful for the snail, and repeated extractions can cause harm or even death.
Hope it helps!!
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No biaxial stress limit given. Default f12 used.
104 nodes are common between the tied pair. no constraint is formed for these nodes. The nodes have been identified in node set WarnNodeCommonTiedPair.
*tie between surface pair (assembly_cz_surf,assembly_b_srf) is reverted back to type node-to-surface. This case may happen if type surface-to-surface cannot find nodes to tie together or if default acoustic-structural tie is specified involving shells. Please check the surface definitions or specify type=surface to surface for acoustic-structural tie.
For *tie pair (assembly_cz_surf-assembly_b_srf), not all the nodes that have been adjusted were printed. Specify *preprint,model=yes for complete printout.
52 nodes have been adjusted. The nodes have been identified in node set WarnNodeAdjust.
*tie between surface pair (assembly_cz_surf,assembly_t_srf) is reverted back to type node-to-surface. This case may happen if type surface-to-surface cannot find nodes to tie together or if default acoustic-structural tie is specified involving shells. Please check the surface definitions or specify type=surface to surface for acoustic-structural tie.
For *tie pair (assembly_cz_surf-assembly_t_srf), adjustment was specified but no node was adjusted more than the adjustment distance = 2.22000e-16.
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Did you figure this out? I am trying to model some wedges which are partially in contact, after applying a load I will force the wedges to bend down and come in contact with a substrate (Master or slave surface). I am getting this error:
slave nodes for surface pair (assembly_surf-glass,assembly_surf-wedges) are reverted back to type node-to-surface. This case may happen if type surface-to-surface cannot find some nodes to form the constraint. Some of reasons are: the slave is coarser or larger than the master surface, the slave is not flat relative to the master surface, or slave nodes that are beyond the extent of the master surface.
6162 slave nodes either found no intersection with a master surface or outside the adjust zone.
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Two weeks ago I found a peculiar crab in the intertidal zone in SW Florida. when found, the crab was not utilizing a shell. It was similar shaped to porcelain crabs found in our area, but with smaller claws (red tipped) and the 5th perepod was flipped up on the dorsal size of the carapace. The eyes were also uniquely positioned on the ventral side of the animal. Upon collection, the crab was observed carrying a cockle shell half. It fit particularly snug in this shell, which leads me to believe this is a commonly used shell for this species. Any assistance on identification and/or resources would be appreciated.
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Dear colleagues,
I am working with Python scripting on Periodic Boundary Conditions (PBC) for a GYROID unit cell in Abaqus. I used SHELL elements in Abaqus.
However, I have difficulty applying PBC on the corners of Gyroid because Gyroid only has 6 corners (C1, C2, C3, C5, C7, C8) and it does not have nodes (materials) on nodes C4 and C6 as shown in the figure, thus I cannot apply linear constraint equations to the node pairs related to C1 and C7.
For your information, I follow this paper to apply PBC for Gyroid: Omairey, Sadik L., Peter D. Dunning, and Srinivas Sriramula. "Development of an ABAQUS plugin tool for periodic RVE homogenisation." Engineering with Computers 35 (2019): 567-577.
If anyone knows this issue, could you please help me? I really appreciate this.
Thank you so much,
Best regards,
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Dear Professor Wenbin Yu,
Thank you so much for your suggesstion.
It is very useful for me and of course I will have a look at "Mechanics of structure genome (MSG)".
Just for your information, my main issue is that Gyroid does not have materials at corners C4 and C6. To overcome this issue, I just created additional nodes at these locations and then I can apply PBC to the unit cell.
Best regards,
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The samples are Periwinkle shells, clam shells, whelks shells and snail shells. they were chemically activated by Sulphuric acid and Potassium Hydroxide.
The SEM and FTIR imagery is required for my Thesis.
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You can check in with Allschoolabs scientific. Equipped with some of Nigeria's Best equipment currently . See Details - analysis.allschoolabs.com
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Hello,
I have carbon-coated Sn (Sn@C) nanoparticles in the powder form with the size ranging from 20-100 nm. I want to transform these core-shell structures to yolk-shell or hollow ones, so I need to obtain extra void in the core (Sn) without damaging the carbon shell onto the Sn layer. I have found a couple of paper about Sn etching or Sn-based alloy etching. I see that the Sn etching solution are HNO3 and water solution in 1:1 ratio, some of them HNO3: MetOH/EtOH solution in 2:1 ratio or like 0.5 M HNO3, but I haven't seen reliable procedure or like etch rate something. Since I never worked with it I wonder if someone can give me tips for safe handling such as which component I add first and what is the max temperature for it?
If you have any recommendation how to etch Sn safely and in a controlled manner, I would be grateful.
Thanks!
Aylin
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Thank you so much for your detailed answer and your effort.
I haven't found a specific procedure yet or an expert in this field that I can consult. But I hope I will find a way in the light of these papers you suggested.
Regards,
Aylin
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i already have a model but i am having challenges regarding the catalyst effect. If anyone can give me a guidance ?
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Your are modelling on ASPEN PLUS?
Modeling the effects of Na2CO3 as a catalyst for hydrogen production through the gasification of peanut shells in supercritical water conditions involves considering several factors. Here's a step-by-step guide on how you can approach this:
  1. Define the reaction: The gasification reaction of peanut shells in supercritical water can be represented as follows: CxHyOz (peanut shells) + H2O (supercritical) → CO2 + H2
  2. Determine the reaction kinetics: The rate of the gasification reaction can be influenced by the presence of a catalyst, such as Na2CO3. Experimentally determine the kinetics of the reaction by conducting gasification experiments with different catalyst concentrations and reaction conditions. Measure the rate of hydrogen production as a function of time, temperature, pressure, and catalyst concentration.
  3. Design an experimental plan: Determine the range of parameters you want to investigate, such as temperature, pressure, catalyst concentration, and reaction time. Prepare a set of experiments where you vary one parameter while keeping others constant. This will help you establish the effect of each variable and build a comprehensive model.
  4. Collect experimental data: Conduct the gasification experiments according to your plan. Measure the amount of hydrogen produced at different time intervals for each set of conditions. Note the temperature, pressure, catalyst concentration, and other relevant factors.
  5. Analyze the data: Use statistical methods to analyze the experimental data and identify trends and correlations. Plot graphs to visualize the relationship between the variables and the rate of hydrogen production. Look for optimal conditions where the catalyst exhibits the highest activity.
  6. Develop a mathematical model: Based on the experimental data and analysis, develop a mathematical model that describes the rate of hydrogen production as a function of temperature, pressure, catalyst concentration, and other relevant parameters. This model can be in the form of rate equations or kinetic equations.
  7. Validate the model: Validate the developed model by comparing its predictions with additional experimental data that were not used during model development. If the model accurately predicts the experimental results, it can be considered reliable.
  8. Optimize the process: Use the validated model to optimize the process conditions for hydrogen production. Conduct simulations with different operating parameters to identify the optimal temperature, pressure, and catalyst concentration that maximize the hydrogen production yield.
Remember that modeling chemical reactions is a complex task, and the effectiveness of the model heavily relies on the quality and comprehensiveness of the experimental data. It is recommended to consult with experts in the field and refer to existing literature on gasification and catalyst effects to enhance your understanding and improve the accuracy of the model.
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Hi fellow pioneers,
I am working on implementing contact constitutive relations for Abaqus/Explicit. However, I am running into much trouble. This problem seems to relate to the different ways contacts are handled in the two solvers. I could use some insights as to how to properly configure a VUINTER subroutine to work with Abaqus/Explicit.
To demonstrate my problem. I made a test model for Abaqus/Standard and Abaqus/Explicit. The model involves pressing (pressure = 0.1) a single shell element against a rigid shell, then dragging said shell element along the surface of the rigid shell (frictionless). I have a UINTER and a VUINTER subroutine for the two models. The test shows that the Abaqus/Standard model with UINTER subroutine is working as intended while the Abaqus/Explicit model is showing erroneous results. For instance, the shared image shows that with the shell moved from its initial position, a negative contact pressure (CPRESS) zone is created on the rigid shell at the location of the initial position of the deformable shell.
Any thoughts help. Thanks in advance.
Abaqus/Standards model: Cont_Tst_Imp_1.inp and Linear_UINTER_1.f
Abaqus/Explicit model: Cont_Tst_Exp_1.inp and Linear_VUINTER_4.f
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Kindly let me know if you get the solution to your problem
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Hello
I have an FE model (linear elastic material, homogeneous) using shell181 elements. The structure is subject to constant acceleration and undergoes a static analysis (antype,static).
About shell,mid and keyopt(8), Ansys manual reports:
KEYOPT(8) = 2 stores midsurface results in the results file for single or multi-layer shell elements. If you use SHELL,MID, you will see these calculated values, rather than the average of the TOP and BOTTOM results. You should use this option to access these correct midsurface results (membrane results) for those analyses where averaging TOP and BOTTOM results is inappropriate; examples include midsurface stresses and strains with nonlinear material behavior, and midsurface results after mode combinations that involve squaring operations such as in spectrum analyses
My midsurface results are not the average of top and bottom results, despite linear material and static analysis.
Just as an example for one element, I have for Von Mises (PRETAB):
ELEM STOP SMID SBOT
41848 0.20593E+008 0.60772E+007 0.26821E+008
where SMID, Von mises at shell,mid location, clearly is not the average between top and bottom.
So, why is this behavior happening given that I have linear material and no response spectrum analysis?
Thanks in advance.
Mathias
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Von Mises is a nonlinear function of stress components, which are the output averaged.
The average of von Mises is, in general, not equal to the von Mises of average stresses.
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Hi,
I would like to apply a defined value of initial stress on 3D Shell elements in the initial step in Abaqus CAE. These shell elements are connected to a 3D Deformable Solid by a Tie Constrain. I have also tried to connect them through "shell-to-solid-coupling" constrain, but the same result. After the initial step, I provided a self-equilibrium step without any loading (Figure 4).
My problem is that after the next steps when loading starts a fast relaxation of this shell element (Figure 1) occurs without transferring the stresses to the tied 3D Solid shape (Figure 2). The tie properties are as shown in Figure 3.
My question is how to transfer a prestressing load (predefined field: stress) from a shell element to a 3D Solid, tied to each other since the main reason for this prestressing is to provide a negative deflection in the main structure?
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Aung Nyein Soe , your code is not correct and it is likely that your fortran compiler is not able to compile it. Indeed, according to Fortran 77 standards, all Fortran statements must be written in columns 7 to 72, which is not the case in your code (e.g. lines 20, 21 and 28).
Also, lines 56 to 61 do not make sense as you are trying to assign a value to an array, which is not possible for Fortran 77 (and also probably not what you want to do). The indexes of S11, S22... arrays are likely missing.
Before running an abaqus simulation, you should first try compiling your code to make sure no obvious programming mistake is present.
Charles
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The reason why I have not shared my publications in the ResearchGate forum is they are protected by the respective publisher with Copyright laws. Knowing this, can someone explain to me how I can share my publications with requests on this forum?
Thanks.
Best Regards
Allen Aradi
Senior Fuels Scientist - Products
Shell Global Solutions (US) Inc.
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I molded a simply supported beam (as shell element) under uniform downward load.
But dont know why s33 is zero while s22 has obvious stress profile?
In my understanding, s33 (should be in z direction) should be bending stress(normal stress), it should not be zero under bending.
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The conventions used in Abaqus for shell elements are as follows.
  1. Stress components are presented in local coordinate system. The default local 1-direction is the projection of the global x-axis onto the element surface. If the global x-axis is within 0.1° of being normal to the surface, the local 1-direction is the projection of the global z-axis onto the element surface. The local 2-direction is then at right angles to the local 1-direction, so that the local 1-direction, local 2-direction, and the positive normal to the surface form a right-handed set. The positive normal direction is defined in an element by the right-hand rotation rule going around the nodes of the element.
  2. Out-of-plane stress S33 is calculated as zero.
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Can anyone identify orange feature 12 on this female Ocenbera erinaceus? The image showing feature 12 is of the animal removed from the shell with the mantle left intact over the features. In the other image the mantle has been mostly removed. Confirmation/correction of other features is welcome.
1: translucent mantle (other features seen through it).
2: thickened mantle edge.
3: mantle extension forming respiratory siphon (unrolled).
4: osphradium at base of siphon.
5: ctenidium.
6: hypobranchial gland containing greenish hypobranchial mucus.
7: rectum.
8: black rectal gland.
9: heart.
10: kidney.
11: visceral lump containing digestive gland and, in breeding season, ovary.
12: ?
13: afferent vessel of ctenidium.
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13 should be 'efferent' not 'afferent' as it takes oxygenated haemolymph away from the ctenidium.
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Hi everyone,
I'm running shell buckling analysis with a shell with perfect geometry and consider geometric nonlinearities. The riks algorithm is set on automatic incrementation. In many cases, the solver gives out a warning message reporting negative eigenvalues, which means, that the bifurcation load may have been exceeded. However, the algorithm still increases the load proportionality factor and just 'runs over' the bifurcation load. This also happens if I decrease the initial and maximum increment. My solution so far is to check the message file for negative eigenvalues. However, this is inconvenient for automatisation of evaluation. Do you know of any other solution?
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Just to expand on what Giovanni Zucco has said and to clarify a couple of common misconceptions. There is no "issue" in what Riks is doing; in fact, it is behaving exactly as it should. The Riks arc-length method is a Newton solver for tracing solutions to a system of equations with the ability of passing a limit point, i.e. a maximum or minimum, in the driving parameter. At a limit point the number of negative eigenvalues of the tangent stiffness matrix will always change, i.e. if a limit point corresponds to a loss of stability the change is from 0 to 1 negative eigenvalues. But a limit point isn't the only way a system can lose stability. The second possible instability for a single changing parameter is a bifurcation point, where a second equilibrium path intersects your current one. Depending on the nature of this bifurcation point (super- or supercritical) and depending on which path of the bifurcation manifold the solver is currently on, the number of negative eigenvalues may change or may not change. In structural applications when we start at zero load, the solver will generally be on some fundamental path with 0 negative eigenvalues and if it passes a bifurcation point before reaching a limit point will then show a change from zero to one negative eigenvalue. At this point you have reached an instability and the structure will buckle if modelled dynamically rather than quasi-statically. There is nothing "wrong" with Riks in continuing on the fundamental path, however, because its purpose is to follow an equilibrium branch in a direction tangential to the current path. To perturb the solver onto the bifurcated path one could (i) keep the structure perfect and push the Riks solver onto the bifurcated path (branch switching), e.g. using a secondary force or changing the predictor, or (ii) embed an imperfection which breaks the perfect bifurcation such that the imperfect prebuckling and imperfect postbuckling curves are connected. The second option is the more straightforward in commercial FE packages but has significant limitations when mutliple bifurcation points are nearly coincident as different imperfections will trigger different buckling modes. As such the Riks solver doesn't give a "false" buckling load, because one should always be looking at the number of negative eigenvalues while path-following.
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Hello
I am using the LSDYNA shell element to simulate the I-beam. I set the offset of the shell element thickness, which can be displayed in the pre-processing stage, but the shell element still does not offset in the post-processing stage. What may be the reason and how can I solve this problem?
Any suggestions would be appreciated.
thank you!
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I am seeking advice for something I found in sediment samples of a Norwegian fjord.
The sediment samples were taken at approximatley 40 - 50 m water depth and contain something that we firstly classified as foraminifera. Quickly we decided that it must be something else and were unfortunatley not able to find out what until today. It could be another microfossil, some biogenic particle such as an egg or maybe even something anthropogenic. The shape has always the same size of about 150 µm, appears throughout all of our sediment cores and seems to be more abundant at 1 m depth than at the top. It has a calcareous "shell" and contains a honey-like substance. I am attaching pictures taken with a light microscope.
I would be happy to solve the mistery and find out what this might be!
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Thank you very much for your help!
It seems more and more likely, that the structures acutally might be eggs.
Reverse image search did not produce any helpful output unfortunatley.
It´s indeed a beautiful area, yes! - I will keep you updated in case I find out more!
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The purity (%) percentage. I have the DDA value, XRD, FTIR, Tg, TGA, and SEM. If any one can please help me.
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DDA is much more applied technique to determine the purity of chitosan indeed but you can try CPMAS C13 NMR also.
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As we know that a shell can be modeled as hybridization of a cavity and sphere. There is equation to find out the two different mode frequency of a metal shell if the dimension and bulk plasmon frequency is known.
When the structure is a core-shell, these two modes of hollow shell will again interact with Au sphere and provide different modes of core-shell structure.
The equation used to find out the hollow shell mode has a provision of a single bulk plasmon frequency. Whenever it comes to a core-shell structure, there are two bulk plasmon frequencies.
My question is what is the equation to find out the interaction of core and different modes of hollow shell?
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As I have gone through some papers on this hybridization modes, I have found that there is a simple equation that can give modes for a hollow shell.
some groups have also carried out for multishelll and even for core-shell. For that first they have calculated modes of different shells and then found out the interaction.
But no where I have found the formulation to get particular wavelength.
I want to know how to get that equations which will give wavelengths of different coupled modes after interaction. I know the equation to calculate modes of plasmon for single hollow nanoparticle.
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I am trying to coat gold nanostars with mesoporous silica shell but many AuNSs are coated with silica instead of one individual nanostar. Anyone has any idea why and what I can do to have one nanostar coated with silica.
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Hi Hanieh, The issue you are experiencing may be due to the synthesis conditions or the properties of the AuNSs. It's possible that the AuNSs are aggregating or clustering together during the coating process, which could result in multiple nanostars being coated with silica instead of individual nanostars.
One potential solution to this problem is to try modifying the synthesis conditions to prevent aggregation or clustering of the AuNSs. This could involve optimizing the pH, temperature, or reaction time of the coating process to promote the formation of individual nanostars. Another solution could be to modify the surface of the AuNSs prior to coating to make them less likely to aggregate or cluster.
It may also be helpful to consult with other researchers or experts in the field who have experience with similar coating processes to gather additional insights and suggestions for optimizing your coating process.
If you're ever in need of more personalized research support, our services (e.g. consulting, data analysis, editing, technical writing, and scientific illustration) can provide tailored solutions to help you achieve your academic goals and save you valuable time. If you're interested in learning more about our services, please feel free to send me a message.
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