ArticlePDF Available

A quantum similarity discussion about Einstein–Podolsky–Rosen (EPR) paradox in Gaussian enfolded spaces

Authors:

Abstract

The Einstein–Podolsky–Rosen discussion about the completeness of quantum mechanics is examined using Gaussian enfolded Euclidian spaces. The research is performed within a quantum similarity framework, forming Gaussian quantum polyhedra. The analysis is achieved through simplified descriptions of quantum systems using appropriate Minkowski normalized Gaussian density functions.
1 23
Journal of Mathematical Chemistry
ISSN 0259-9791
J Math Chem
DOI 10.1007/s10910-020-01158-7
A quantum similarity discussion about
Einstein–Podolsky–Rosen (EPR) paradox in
Gaussian enfolded spaces
Jing Chang & Ramon Carbó-Dorca
1 23
Your article is protected by copyright and
all rights are held exclusively by Springer
Nature Switzerland AG. This e-offprint is
for personal use only and shall not be self-
archived in electronic repositories. If you wish
to self-archive your article, please use the
accepted manuscript version for posting on
your own website. You may further deposit
the accepted manuscript version in any
repository, provided it is only made publicly
available 12 months after official publication
or later and provided acknowledgement is
given to the original source of publication
and a link is inserted to the published article
on Springer's website. The link must be
accompanied by the following text: "The final
publication is available at link.springer.com”.
Vol.:(0123456789)
Journal of Mathematical Chemistry
https://doi.org/10.1007/s10910-020-01158-7
1 3
ORIGINAL PAPER
A quantum similarity discussion
aboutEinstein–Podolsky–Rosen (EPR) paradox inGaussian
enfolded spaces
JingChang1· RamonCarbó‑Dorca2
Received: 15 May 2020 / Accepted: 27 June 2020
© Springer Nature Switzerland AG 2020
Abstract
The Einstein–Podolsky–Rosen discussion about the completeness of quantum
mechanics is examined using Gaussian enfolded Euclidian spaces. The research is
performed within a quantum similarity framework, forming Gaussian quantum poly-
hedra. The analysis is achieved through simplified descriptions of quantum systems
using appropriate Minkowski normalized Gaussian density functions.
Keywords Einstein–Podolsky–Rosen (EPR) paradox· Gaussian enfolded spaces·
Quantum similarity· Gaussian functions· Quantum density functions· Quantum
polyhedra· Variance of a quantum polyhedron
1 Introduction
The Einstein, Podolsky, and Rosen (EPR) 1935 paper1 [1] on the completeness of
quantum mechanics originated myriads of discussions in the form of journal contribu-
tions, varied scientific essays, and books. Reviewing this extensive bibliography in a
very condensed way, the paper of Bell [2] could be quoted as a single summary of the
literature associated with the so-called EPR paradox in the mid of the 20th century.
Some modern 21st-century papers can also be mentioned [311], considering not only
the quality of these papers’ discussions on EPR and related experiments and problems
* Ramon Carbó-Dorca
ramoncarbodorca@gmail.com
Jing Chang
jchang5@ualberta.ca
1 Department ofChemical andMaterials Engineering, University ofAlberta, Edmonton,
ABT6G2V4, Canada
2 Institut de Química Computacional i Catàlisi, Universitat de Girona, 17071Girona, Catalonia,
Spain
1 Note a curious characteristic: the EPR publication possesses no references at all.
Author's personal copy
Journal of Mathematical Chemistry
1 3
but also the additional literature on the EPR problem, which can be obtained from the
included papers’ references.
Choosing to discuss the EPR paradox from the quantum similarity point of view
corresponds to a fourfold purpose. First, the interest of the EPR paradox has aroused
in one of the present authors [12, 13]. Second, the three research lines developed
by one of us within the framework of the enfolded Gaussian spaces [1417]. Third,
the quantum similarity description of sets of quantum systems developed during the
last decades [2040] in our laboratory. Finally, one can mention our interest in the
research about the time-like evolution of systems [4144], as well as the point of
view of time description [45] for general purposes. The relevance of the present study
to the chemical and physical evolution of submicroscopic systems is thus obvious.
Accordingly, the present study will be organized as follows. First, Gaussian func-
tions as a quantum system straightforward descriptor set will be discussed.
Then, the Gaussian enfolded Euclidian spaces will be set up. Application of the
enfolded spaces to the description of a quantum system evolution will be given next.
The splitting of a quantum system in several subsystems will be presented in the
next section, providing the appearance of a Gaussian quantum polyhedron. Time-
like parameters and description of quantum polyhedra evolution will follow.
The definition of the similarity matrix of a Gaussian quantum polyhedron will
be presented, to illustrate and follow the evolution of the original quantum system,
once splits into a collection of subsystems.
The time-like evolution of the subsystem collection in the form of a Gaussian
quantum polyhedron will follow. Finally, the quantum polyhedron variance will be
discussed as an alternative way to study the EPR paradox.
2 Gaussian functions asdensity functions
A Gaussian function centered at a point
𝐑A
can be written through the following
expression:
where the exponential parameter
𝜃
is responsible for the Gaussian function form.
Smaller values of
𝜃
resultant function is Minkowski yield a flattened Gaussian struc-
ture, while larger values of the same parameter make the Gaussian dense at the func-
tion origin
𝐑A
. In such a way one can write the Gaussian function as a Dirac’s delta
function at the parameter infinite limit:
lim
𝜃
exp
𝜃
𝐫𝐑A
2
=𝛿
𝐫𝐑A
.
The Minkowski norm of the Gaussian function (1) is easily calculated to be:
and
n
stands for the dimension of the space where the variable vector
belongs.
(1)
g
A(𝐫
𝜃)=exp
𝜃
𝐫𝐑A
2
,
gA
=
D
gA(𝐫
𝜃)d𝐫=
𝜋
𝜃
n
2
Author's personal copy
1 3
Journal of Mathematical Chemistry
Therefore, using
𝜃=𝜋
in the Eq. (1), the resultant function is Minkowski
normalized:
g
A(𝐫
𝜋)=exp
𝜋
𝐫𝐑A
2
gA
=
1
.
Gaussian functions are positive definite functions, and the structure of the
Minkowski norms permits to describe exponent parameters, which can be associated
with several particles
Z
. Thus, one can write:
gA
=Z
𝜋
𝜃
n
2
=Z𝜃=
𝜋
Z
2
n
,
Therefore, one can consider a Minkowski normalized Gaussian function repre-
senting several particles
Z
and centered at the point
𝐑A
as:
Although the variable space might be generally described, the space holding
quantum systems with a finite number of particles can be taken as the usual three-
dimensional Euclidian one, and then the dimension parameter is chosen as:
n=3
.
Because of this above discussion, the Gaussian function of the Eq. (2) can be
considered as a simplified quantum density function of a system of
Z
particles, cen-
tered at the position
𝐑A
of a three-dimensional space. Such a Gaussian function used
as a simplified quantum density function has been recently used to describe the ele-
ments of the periodic table and discuss their relationships [46].
3 Gaussian enfolded Euclidean space
The Gaussian function in the Eq.(2) when written in a manner, such that no precise
specific position of the center is given, can be presented like:
and the location of the center might also be seen as a new variable vector
𝐑.
Then the Gaussian function (3) can be considered as a set of Gaussian functions
of the variable
𝐫
which are centered at any of the Euclidian space points
𝐑.
Looking at the previous definitions differently: the Gaussian functions of type (3)
enfold the Euclidian space in such a way that any point of it contains an associated
Gaussian function. Such a geometrical construct has been described, discussed, and
used in several papers [1417]. This enfolding space structure can be traced in sev-
eral spaces, where each point is associated with a function [17].
If one considers the structure of the quantum vacuum, see for instance [18, 19], it
can be seen as the enfolding (3) with the parameter
Z=1
. Therefore, like:
which assigns a Gaussian function to every point in Euclidian space, as the Gaussian
(4), except for a convenient exponent, corresponds to the ground-state wave function
of the quantum harmonic oscillator.
(2)
g
A(𝐫
Z)=exp
𝜋Z
2
n
𝐫𝐑A
2
.
(3)
g
(𝐫
|
𝐑
|
Z)=exp
(
𝜋Z2
n
|
𝐫𝐑
|
2
)
(4)
g
(𝐫
|
𝐑)=exp
(
𝜋
|
𝐫𝐑
|2),
Author's personal copy
Journal of Mathematical Chemistry
1 3
If in the Eq.(3), the number of particles associated with the function tends to zero,
the exponent tends to infinity, and the function transforms into a Dirac’s delta function.
Thus, the Gaussian enfolded space corresponds to a Dirac function enfolded space; if
instead of a quantum vacuum, one prefers to describe the void space as a zero-particle
density function enfolding.
4 A quantum system description withinaGaussian enfolded space:
theinitial enfolded Euclidian space
Now suppose that the Euclidian space is Gaussian enfolded. In the absence of any sys-
tem, the vacuum could be constructed by Dirac’s functions assuming in this case that
it is void. Alternatively, one can admit an enfolding with Gaussian Minkowski normal-
ized functions, containing one virtual particle at each point. In both cases, the Dirac’s
delta function or the virtual particle Gaussian function transforms into a quantum den-
sity Gaussian function of the kind described in the Eq. (3), when a quantum system
appears at the space position
𝐑.
5 The appearance ofaquantum system of
Z
particles
According to the previous development, any quantum system with several
Z
particles
could be supposedly located at any point R in Euclidean space and might be approxi-
mated by a Gaussian function as depicted in the Eq.(3). Thus, at this point, the virtual
particle becomes a quantum system.
Moreover, due to space isotropy, it is indifferent to where the system is located.
Therefore, to start with, the origin of coordinates is chosen as the site where the quan-
tum system is located. That is:
𝐑=𝟎
and the Gaussian function acting as the quantum
system density function might be written:
6 Time asanatural sequence ofparameters
Now, to simply describe the time-like evolution of a system, time can be considered
as a natural sequence of time-like click values:
𝜏={0, 1, 2, ,t,},
where at each
value, the whole enfolded space appears changed or unchanged. That is, at
𝜏=0
the
entire space is enfolded by one virtual particle Gaussian density functions, while at
𝜏=1
, for instance, a system defined by a density function like Eq.(5) does appear.
(5)
g
(𝐫
|
𝟎
|
Z)=exp
(
𝜋Z
2
n
|
𝐫
|
2
).
Author's personal copy
1 3
Journal of Mathematical Chemistry
7 Splitting oftheinitial quantum system intoaset ofseveral
subsystems
At a random time value:
𝜏=t
, one can suppose that the initial quantum system
ceases to be stationary and splits into a set of N subsystems, each one possessing
several particles arbitrarily different one from the other. That is, one deals a collec-
tion of subsystems with a specific number of particles:
{
Z
I|
I=1, N
}
and every one
of them is located into a set of points:
{
𝐑
I|
I=1, N
}
of the enfolded space.
Then, in the absence of particle creation or annihilation, the following relation
will hold:
and the set of subsystems will be described by a set of Gaussian density functions,
which can be written as:
At successive time-like clicks, the positions of the subsystems might change.
Thus, the positions of subsystems could be described as functions of the time-like
parameter, using the convention:
I=1, N𝐑I
𝐑I(𝜏)
.
The set of subsystem density functions
𝐏
can be easily recognized as a quantum
polyhedron,2 see references [4756] to have more information on the definitions and
properties of this subject. Each subsystem Gaussian density function could be asso-
ciated with a vertex of the quantum polyhedron. The definition (6) can be particu-
larly named as a Gaussian quantum polyhedron.
8 Asynchronous evolution ofaquantum system toquantum
polyhedra
Evolution, as previously defined, from the original quantum system to a Gaussian
quantum polyhedron, has been performed as a synchronous phenomenon. A more
general situation might be associated with an asynchronous evolution encompass-
ing the synchronous one. In this case, the time-like natural parameter
𝜏
is trans-
formed into a time-like N-dimensional natural vector:
𝛕
K
=
𝜏
K;I
I=1, N
. In
such a way the successive polyhedra vertices are located at the enfolded space as:
I=1, N𝐑
I
𝐑
I(
𝜏
K;I)
, in this manner, each subsystem position depends on an
independent time-like parameter, a situation similar to several descriptions previ-
ously published in this journal [4145]. The subindex K corresponds to an asynchro-
nous time-like vector click, composed of N sub-clicks.
Z
=
N
I=1
Z
I
(6)
𝐏
=
g
I
𝐫
𝐑
I
Z
I
I=1, N
.
2 In the previous literature dealing with sets of density functions and in the present paper the term quan-
tum polyhedron is used instead of quantum polytope.
Author's personal copy
Journal of Mathematical Chemistry
1 3
To transform the time-like evolution of a quantum polyhedron from an asyn-
chronous process to a synchronous one, one just needs to take into account that
the time-like vector transforms into a time-like homothecy of the N-dimensional
unity vector
𝟏=(1, 1, 1 ,1
)
, that is:
𝛕
K
=𝜏
K
𝟏
.
Thus, one can see that, in any case, the evolution of the subsystem quantum
polyhedron could be described with a time-like vector. The structure of such a
vector will tell if the evolution process is synchronous or asynchronous.
9 Algebraic characterization oftheGaussian quantum polyhedron:
thesimilarity matrix
Transformation of the original point-like quantum system into a Gaussian quan-
tum polyhedron can be characterized, considering the nature of their vertices
at each time-like click. At every click, the quantum polyhedron vertices form a
set of functions which can supposedly interact via a Hermitian operator
𝛺
, say,
forming a symmetric
(N×N)
matrix
𝐙
so that one can write for every pair of
vertices:
Applying such a procedure to quantum polyhedra, in general, has been dis-
cussed and used to many quantum chemical problems, see [4756] as examples.
It also corresponds to the basis of the so-called quantum similarity, for more
information see references [2040].
The integral appearing in the Eq. (7) can be easily described through the
expression:
as it has been discussed from the quantum similarity initial times [2025].
If the operator
𝛺
is positive definite, then theoretically, the matrix
𝐙
is also
positive definite. In case the operator coincides with a Dirac’s delta function,
that is:
𝛺(
𝐫
1
;𝐫
2)
=𝛿
(
𝐫
1
𝐫
2)
, then the matrix
𝐙
corresponds to the overlap
between the pairs of Gaussian density functions associated with the vertices of
the quantum polyhedron.
In this circumstance, the interaction matrix can also be considered as the met-
ric matrix of the space subtended by the vertices of the quantum polyhedra, con-
structed in turn by the subsystem’s Gaussian density functions.
In quantum similarity lore, the matrix
𝐙
is named as the similarity matrix of
the quantum polyhedron.
Of course, the interaction or similarity matrix will depend on the time evolu-
tion of the quantum polyhedron. And this will be done via the position of the
polyhedron vertices within the Gaussian enfolded space.
(7)
I,J=1, Nz
IJ
=
g
I
𝛺g
J
𝐙=
z
IJ
I,J=1, N
,
I,J=1, N
gI𝛺gJ
=
D
gI
𝐫1
𝛺
𝐫1;𝐫2
gJ
𝐫2
d𝐫1d𝐫
2
Author's personal copy
1 3
Journal of Mathematical Chemistry
10 The Einstein–Podolsky–Rosen paradox andthetime‑like
evolution ofaGaussian quantum polyhedron
The diagonal elements of the interaction matrix
𝐙
are stationary because they
only depend on the exponents, but not on the position in the enfolded space, that
is:
This point is interesting to note because even if the non-diagonal elements of
the interaction matrix become exactly null, then the interaction matrix could be
associated with the diagonal matrix defined by the elements of the Eq.(8).
However, the nature of the simplified description of the subsystem quantum
polyhedron in the form of Gaussian vertices allows saying that even at large, but
finite, distances the non-diagonal elements of the interaction matrix might be
small, but non-null.
One can measure the time-like evolution of the generated quantum polyhedron
via the expression:
where the trace of the interaction matrix
𝐙
corresponding to the first term in the
Eq.(9) is a stationary constant. As already commented, the second term will be non-
zero even at considerable but finite distances.
Therefore, within the time-like evolution of a quantum polyhedron, associated
with the subsystems that appeared from an initial quantum system, the interaction
among them will be non-zero throughout such time-like evolution.
It seems that from this point of view, using certainly a simplified model such
as the one proposed here, there is a steady interaction among all the parts that one
can suppose are split from a unique initial system.
No spooky action at a distance seems to be present. It merely appears the well-
defined sum of subsystem interactions.
11 Quantum polyhedron variance asameasure ofsubsystems’
interaction
The variance
m[2]
of a quantum polyhedron has been discussed in many instances.
See, for example, references [48, 49]. It could be considered as a measure of the
collective behavior of an indefinite number of subsystems. It must be kept in
mind the fact that being the variance positive definite by construction [56], its
value will be in any circumstance greater than zero in this case.
Initially, a function is needed to construct the polyhedron variance. It corre-
sponds to the so-called polyhedron centroid [55]:
(8)
I=1, Nz
II
=
g
I
𝛺g
I
=f
Z
I.
(9)
J
=
N
I=1
zII +1
2
N
I=1
N
J=1
𝛿(I
J)z
IJ
Author's personal copy
Journal of Mathematical Chemistry
1 3
then, once described the Gaussian quantum polyhedron, as explained in the present
work and defined in the Eq.(6), leading to a well-defined interaction or similarity
matrix
𝐙
, this also permits to compute a scalar acting as the variance of the polyhe-
dron. The variance can also be easily computed as:
and the trace of the similarity matrix corresponds to the first term sum appearing in
the Eq.(9). In contrast, the complete sum of the elements of a matrix noted as:
𝐙
,
corresponds to the second part of the variance expression.
In fact, the Eq.(11) is somehow related to a mean value of the interaction of
the quantum polyhedron, as expressed in the Eq.(9). To see such a relation, one
might split the interaction matrix into the sum of two matrices, the diagonal
𝐙D
and the off-diagonal
𝐙O
parts, according to:
Then, using the fact that the complete sum of any matrix is a linear operator,
one can write:
and considering that:
Tr
[𝐙]=
𝐙
D
, the quantum polyhedron variance can also be
written as:
An expression, which can be associated with an average over the elements of
the interaction or similarity matrix. As in Eq.(9), the first term of the variance is
a sum involving the diagonal elements, invariant upon the polyhedron evolution.
While the second term, associated with the sum of off-diagonal interaction matrix
elements, corresponds to a term diminishing as the subsystems become more dis-
tant in the enfolded Euclidian space.
At the light of its definition and considering its connection with the interaction
matrix, the quantum polyhedron variance can also be taken as a measure of the
(10)
g
C=N1
N
I=1
gI
,
(11)
m
[2]=N1
N
I=1D
gI
2d𝐫D
gC
2d𝐫
=N1
N
I=1
zII N2
N
I=1
N
J=1
zIJ =N1Tr[𝐙]N2
𝐙
𝐙=𝐙
D
+𝐙
O
𝐙
D={zII |I=1, N}
𝐙
O=𝐙𝐙D=
{
𝛿(IJ)z
IJ |
I,J=1, N
}
𝐙
O
=
𝐙𝐙
D
=
𝐙
𝐙
D
𝐙
=
𝐙
D
+
𝐙
O
m[2]
=N
1
Tr [𝐙]N
2
𝐙=
N
1
N
2
𝐙
D
N
2
𝐙
O
=N2
(N1)
𝐙D
𝐙O

Author's personal copy
1 3
Journal of Mathematical Chemistry
action at a distance between the collection of subsystems, which has evolved from
an original quantum system.
Such a relationship will never fade away, whenever one does accept the possi-
bility of very large, but finite, distances between the subsystems.
12 Description oftheinitial quantum system alongwithits time‑like
evolution
As described in the previous sections of this study, the time-like evolution of
subsystems seems to do not consider the original quantum system. Practically,
the evolution of the subsystem set has been studied, which has been supposedly
formed by an arbitrary number of elements, to discuss the problem in the middle
of a very general situation.
However, in the geometrical structure of the Gaussian quantum polyhedron
subsystem set does appear, along with the time-like evolution, the essence of the
original quantum system. Indeed, one can again think about the density functions
of a set of subsystems, as the quantum polyhedron described in the Eq.(6) is used
here. A superposition similar to the Eq.(10) but scaled by the number of quantum
subsystems might be constructed:
such that the Minkowski norm of the function
gO
can be easily calcu-
lated:
gO
=
N
I=1
gI
=
N
I=1
ZI=
Z
,
Therefore, the superposition (12) has the same Minkowski norm as the original
quantum system function (3). The meaning of this can be associated to the fact
that an initial quantum system splitting into
N
quantum subsystems, whatever his
time-like evolution might be, remains entangled.
12.1 Convex evolution ofthequantum subsystem set
Alternatively, starting from the entanglement shown in the analysis of Eq.(12),
one can take the vertices of the quantum polyhedron
𝐏
as a basis set to construct a
quantum system Gaussian density function. An original quantum system density
might be reconstructed at every time-like click, as a convex linear combination:
which must be Minkowski renormalized, because:
(12)
g
O=NgC=
N
I=1
gI
,
(13)
g
c(𝐫
𝜃)=
N
I=1
cIgI𝐫
𝐑I
ZI
N
I=1
cI=1cI[0, 1]
,
Author's personal copy
Journal of Mathematical Chemistry
1 3
The renormalization described in the Eq. (14) could be avoided in case that,
instead of using density functions, one uses shape functions, see, for example, Ref.
[57]. However, for the present study, it is enough to show the possibility of describ-
ing the original system in the manner of Eqs.(13) and (14), along with the time-like
evolution of the vertices of the subsystem quantum polyhedron.
Such a possibility is, of course, connected with the fact that all the successive
Gaussian quantum polyhedra vertices remain interacting in their future time-like
evolution.
As a final detail, one can ask about the nature of the convex coefficients used in
the Eq.(13). A possible simple solution that might connect all the particle numbers
involved in the problem, is to define a convex set of coefficients like:
Then the time-like description of the evolution of the original system position in
the enfolded Euclidian space can be written as:
The convex coefficient set, defined in this case as weights involving the number
of particles, also demands a renormalization of the original system density function.
13 Conclusions
Perhaps, if the insight of Born [58] and later the intuition of Kohn [5961], about
the role of density functions in atomic and molecular quantum mechanics, could
have surfaced in the paper of Ref. [1] instead of 10years later, then a considerable
deal of paperwork could be spared.
Maybe, some of the ideas about quantum mechanics and Hilbert spaces expressed
by Anastopoulos [62] at the turn of the century, will agree with some points of view
of the present paper. Moreover, the recent presentation of Chen [63], promoting the
density function as the origin of information in the quantum universe, provides good
support to the present discussion. Even more recently, a paper by Perelman [64]
describes how mass can be associated to the quantum mechanical density function
and the consequences of this connection into the space–time structure and gravity.
In this paper has been shown, indeed in a very naïve manner, that instead of wave
functions, quantum mechanical density functions might be employed to describe and
(14)
gc(𝐫𝜃)=
N
I=1
cIgI𝐫
𝐑I
ZI=
N
I=1
cIZI=𝜃
g(𝐫
Z)=
Z
𝜃
gc(𝐫
𝜃)
.
I=1, NcI=ZI
Z
N
I=1
cI=Z1
N
I=1
ZI=Z1
Z=1
𝐑
c=
N
I=1
cI𝐑I=Z1
N
I=1
ZI𝐑
I
Author's personal copy
1 3
Journal of Mathematical Chemistry
follow the time-like evolution of a quantum system, after splitting into a collection
of subsystems. This will result in a possible non-null interaction between the subsys-
tems along with their time-like evolution. Therefore, any se of quantum subsystems
issued from a previous system might be considered entangled.
Thus, the interminable debate from 1935 up to present times about spooky inter-
action at a distance between subsystems arising from a unique quantum system,
could have been dramatically shortened.
Compliance with ethical standards
Conict of interest The authors state that there is no conflict of interest related to this work.
References
1. A. Einstein, B. Podolsky, N. Rosen, Can quantum-mechanical description of physical reality be con-
sidered complete? Phys. Rev. 47, 777–780 (1935)
2. J.S. Bell, On the Einstein Podolsky Rosen Paradox. Physics 1, 195–200 (1964)
3. D. Wallace, The quantum measurement problem: state of play. ArXiv:0712.0149v1 [quant-ph] 3
Dec (2007)
4. E. Muchowski, Measurement problem with entangled photons and the possibility of local hidden
variables. Open Phys. 15, 891–896 (2017)
5. M. Kupczynski, Can we close the Bohr-Einstein quantum debate? Phil. Trans. R. Soc. A375,
20160392 (2017)
6. K. Hess, Bell’s theorem and instantaneous influences at a distance. ArXiv:1805.04797v2 [quant-ph]
16 Jun (2018)
7. C.S. Amorim, Indistinguishability as nonlocality constraint. Nat. Sci. Rep. 8, 6091–6102 (2018)
8. M. Fadel, T. Zibold, B. Décamps, P. Treutlein, Spatial entanglement paterns and Einstein-Podolsky-
Rosen steering in Bose-Einstein condensates. Science 360, 409–413 (2018)
9. E. Muchowski, On a contextual model refuting bell’s theorem. A pdf version might be found in https
://doi.org/10.13140 /rg.2.2.29860 .22403 (2020)
10. H. Qiao, Y.P. Kandel, S.K. Manikandan, A.N. Jordan, S. Fallahi, G.C. Gardner, M.J. Manfra, J.M.
Nichol, Conditional teleportation of quantum-dot spin states. Nat. Commun. 11(3022), 1–9 (2020)
11. J. Yin, Y. Li, S. Liao etal., Entanglement-based secure quantum cryptography over 1120 kilometers.
Nature (2020). https ://doi.org/10.1038/s4158 6-020-2401-y
12. R. Carbó-Dorca, A discussion on the Einstein-Podolski-Rosen (EPR) Effect in a unique wavefunc-
tion quantum mechanical framework. J. Math. Chem. 39, 267–279 (2006)
13. R. Carbó-Dorca, On Einstein-Podolski-Rosen (EPR) Paradox. J. Math. Chem. 41, 209–215 (2007)
14. R. Carbó-Dorca, E. Besalú, Geometry of N-dimensional Euclidian space enfoldments. J. Math.
Chem. 49, 2244–2249 (2011)
15. R. Carbó-Dorca, Position-momentum Heisenberg uncertainty in Gaussian enfoldments of Euclidian
space. J. Math. Chem. 51, 420–426 (2013)
16. R. Carbó-Dorca, Enfolded conformational spaces: definition of the chemical quantum mechanical
multiverse under Born-Oppenheimer approximation. J. Math. Chem. 51, 1092–1098 (2013)
17. J. Chang, T. Chakraborty, R. Carbó-Dorca, Theoretical discussion on the double slit experiment and
beyond: the Hückel (HMO) connection. Trends Phys. Chem. 19, 75–80 (2019)
18. D. Song, Comments on vacuum energy of harmonic oscillator. ArXiv:0703124v1 [quant-ph] 14
Mar (2007)
19. J. Conlon, Matter emerges from the vacuum. Oxford Phys. 3, 71 (2013)
20. R. Carbó, L. Leyda, M. Arnau, How similar is a molecule to another? An electron density measure
of similarity between two molecular structures. Int. J. Quant. Chem. 17, 1185–1189 (1980)
21. R. Carbó, B. Calabuig, Molecular similarity and quantum chemistry, Chapter6, in Molecular simi-
larity, ed. by M.A. Johnson, G.M. Maggiora (Wiley, New York, 1990)
Author's personal copy
Journal of Mathematical Chemistry
1 3
22. R. Carbó, B. Calabuig, Quantum similarity: definitions, computational details and applications, in
Computational chemistry: structure, interactions and reactivity, vol. A, ed. by S. Fraga (Elsevier,
Amsterdam, 1992)
23. R. Carbó, B. Calabuig, Molecular quantum similarity measures and n-dimensional representation of
quantum objects I. Theoretical foundations. Int. J. Quant. Chem. 42, 1681–1693 (1992)
24. R. Carbó, B. Calabuig, Molecular quantum similarity measures and n-dimensional representation of
quantum objects II. Practical applications (3F- Propanol conformer taxonomy among other exam-
ples). Int. J. Quant. Chem. 42, 1695–1709 (1992)
25. R. Carbó, B. Calabuig, Quantum similarity measures, molecular cloud description and structure-
properties relationships. J. Chem. Inf. Comput. Sci. 32, 600–606 (1992)
26. R. Carbó, E. Besalú, B. Calabuig, L. Vera, Molecular quantum similarity: theoretical framework,
ordering principles, and visualization techniques. Adv. Quant. Chem. 25, 253–313 (1994)
27. R. Carbó, E. Besalú, Theoretical foundation of quantum similarity, in Molecular similarity and
reactivity: from quantum chemical to phenomenological approaches understanding chemical reac-
tivity, vol. 14, ed. by R. Carbó (Kluwer Academic Publishers, Amsterdam, 1995), pp. 3–30
28. E. Besalú, R. Carbó, J. Mestres, M. Solà, Foundations and recent developments of quantum molecu-
lar similarity. in Current chemistry: molecular similarity I, (Springer, Berlin, 1995), vol. 173, pp.
31-62
29. R. Carbó-Dorca, E. Besalú, A general survey of molecular quantum similarity. J. Mol. Struct. (The-
ochem) 451, 11–23 (1998)
30. R. Carbó-Dorca, E. Besalú, Quantum theory of QSAR. Contribut. Sci. 1, 399–422 (2000)
31. R. Carbó-Dorca, Ll. Amat, E. Besalú, X. Gironés, D. Robert, Quantum molecular similarity: theory
and applications to the evaluation of molecular properties, biological activity and toxicity. in math-
ematical and computational chemistry: fundamentals of molecular similarity, (Kluwer Academic/
Plenum Publishers, 2001), pp. 187–320
32. R. Carbó-Dorca, L.D. Mercado, Communications on quantum similarity (1): density gradient quan-
tum similarity. J. Comput. Chem. 31, 2195–2212 (2010)
33. R. Carbó-Dorca, E. Besalú, Communications on quantum similarity (2): a geometric discussion
on holographic theorem of electron density and confined quantum similarity measures. J. Comput.
Chem. 31, 2452–2462 (2010)
34. L.D. Mercado, R. Carbó-Dorca, Quantum similarity and discrete representation of molecular sets. J.
Math. Chem. 49, 1558–1572 (2011)
35. R. Carbó-Dorca, Quantum similarity, volume functions, and generalized carbó indices. J. Math.
Chem. 49, 2109–2115 (2011)
36. R. Carbó-Dorca, E. Besalú, Centroid origin shift of quantum object sets and molecular point clouds:
description and element comparisons. J. Math. Chem. 50, 1161–1178 (2012)
37. R. Carbó-Dorca, Quantum similarity matrices column set as holograms of DF molecular point
clouds. J. Math. Chem. 50, 2339–2341 (2012)
38. R. Carbó-Dorca, Triple density quantum similarity measures and the tensorial representation of
quantum object sets, in Quantum chemistry: theory and practice, vol. 2, ed. by T. Chakraborty
(Apple Academic Press & Distributed by Taylor & Francis Group, Milton Park, 2012)
39. R. Carbó-Dorca, E. Besalú, EMP as a similarity measure: a geometric point of view. J. Math. Chem.
51, 382–389 (2013)
40. R. Carbó-Dorca, Collective Euclidian distances and quantum similarity. J. Math. Chem. 51, 338–
353 (2013)
41. R. Carbó-Dorca, Inward matrix product algebra and calculus as tools to construct space-time frames
of arbitrary dimensions. J. Math. Chem. 30, 227–245 (2001)
42. R. Carbó-Dorca, Infinite-dimensional time vectors as background building blocks of a space-time
structure. J. Math. Chem. 36, 75–81 (2004)
43. R. Carbó-Dorca, Time vectors and particle swarms defined as polyhedra in spherically enfolded
spaces. J. Math. Chem. 54, 1751–1757 (2016)
44. R. Carbó-Dorca, Boolean hypercubes as time representation holders. J. Math. Chem. 56, 1349–1352
(2018)
45. J. Chang, R. Carbó-Dorca, Fuzzy hypercubes and their time-like evolution. J. Math. Chem. (in print,
Accepted May 4, 2020)
46. R. Carbó-Dorca, T. Chakraborty, Divagations about the periodic table of the elements: Boolean
hypercube and quantum similarity connections. J. Comput. Chem. 40, 2653 (2019)
47. R. Carbó-Dorca, Multimolecular polyhedra and QSPR. J. Math. Chem. 52, 1848–1856 (2014)
Author's personal copy
1 3
Journal of Mathematical Chemistry
48. R. Carbó-Dorca, Quantum polyhedra, definitions, statistics and the construction of a collective
quantum similarity index. J. Math. Chem. 53, 171–182 (2015)
49. R. Carbó-Dorca, D. Barragán, Communications on quantum similarity (4): collective distances
computed by means of Similarity Matrices, as generators of intrinsic ordering among quantum mul-
timolecular polyhedra. WIREs Comput. Mol. Sci. 5, 380–404 (2015)
50. R. Carbó-Dorca, An isometric representation problem related with quantum multimolecular polyhe-
dra and similarity. J. Math. Chem. 53, 1750–1758 (2015)
51. R. Carbó-Dorca, An isometric representation problem in quantum multimolecular polyhedra and
similarity: (2) synisometry. J. Math. Chem. 53, 1867–1884 (2015)
52. R. Carbó-Dorca, Quantum molecular polyhedra in LCAO-MO theory. Mol. Phys. 114, 1236–1249
(2016)
53. R. Carbó-Dorca, Aromaticity, quantum molecular polyhedra and quantum QSPR. J. Comput. Chem.
37, 78–82 (2016)
54. R. Carbó-Dorca, S. González, Notes in QSPR (4): quantum multimolecular polyhedra, collective
vectors, quantum similarity and quantum QSPR fundamental equation. Manage. Stud. 4, 33–47
(2016)
55. R. Carbó-Dorca, A study on the centroid vector of a polyhedron. J. Math. Chem. 54, 51–71 (2016)
56. R. Carbó-Dorca, A theorem on the gram matrix of a polyhedron. J. Math. Chem. 55, 79–97 (2017)
57. P. Bultinck, R. Carbó-Dorca, A mathematical discussion on density and shape functions, vector
semispaces and related questions. J. Math. Chem. 36, 191–200 (2004)
58. M. Born, Atomic physics (Blackie & Son Lim, London, 1945)
59. H.W. Kohn, Inhomogeneous electron gas. Phys. Rev. 136, B864–B871 (1965)
60. W. Kohn, L.J. Sham, Self-consistent equations including exchange and correlation effects. Phys.
Re v. 140, A1133–A1138 (1965)
61. P.C. Hohenberg, W. Kohn, L.J. Sham, The beginnings and some thoughts on the future. Adv. Quant.
Chem. 21, 7–26 (1990)
62. C. Anastopoulos, Quantum theory without Hilbert spaces. arXiv:quantum-ph/0008126v2 27 Feb
(2001)
63. E.K. Chen, Quantum mechanics in a time-asymmetric universe: on the nature of the initial quantum
state. Br. J. Philos. Sci. (2018). https ://doi.org/10.1093/bjps/axy06 8
64. C.C. Perelman, The geometrization of quantum mechanics, the nonlinear klein-gordon equation.
Finsler Gravity Phase Spaces (preprint) https ://www.acade mia.edu/42875 965/ (2020)
Publisher’s Note Springer Nature remains neutral with regard to jurisdictional claims in published
maps and institutional affiliations.
Author's personal copy
... This broader point of view, even outside the actual mainstream molecular structure calculations, has a well-defined mathematical background, as several previous papers [4,[33][34][35][36][37][38] have established. ...
Article
Full-text available
The nature of the quantum mechanical LCAO-MO Mulliken-like description is analyzed in light of constructing basis function enfolded spaces. As a result, the concept of the chemical bond can transform into a collective functional structure, where one considers the whole set of molecular atoms plus enfolding centers as bearing the chemical bond in various collective forms. Such an endeavor permits the discussion of many collateral subjects like density bond matrices, polyatomic bonds, quantum molecular polyhedra, and bond comparisons. Keywords: LCAO-MO; chemical bond; enfolded spaces; basis sets; collective chemical bonds; first order density function; density bond matrix; quantum molecular polyhedra; bond comparison 1. Foreword The present study describes a purely theoretical point of view about the concepts created around the chemical bond via applying the principles of quantum mechanics. The authors intend to advise future readers on the possible applications of the mathematical descriptions in this paper, but they do not perform any computational practical development here. Such planning can be based on the authors' desire to show the pathways further quantum chemical development can follow, remaining neutral about choosing which one. In some cases, they have intervened within [1] or promoted books [2] that try to present some trendy topics in 21 st-century quantum chemistry. Powerful available codes, adapted to many computational purposes, are present in the era of powerful electronic computational means at the dawn of quantum computing [3]. Then, what can be foreseen as a starting point providing new insight into the already typical quantum chemical molecular computation setup could be included and used systematically in the future.
... This broader point of view, even outside the actual mainstream molecular structure calculations, has a well-defined mathematical background, as several previous papers [25][26][27][28][29][30][31] have established. ...
Preprint
Full-text available
The nature of the quantum mechanical LCAO-MO Mulliken-like description is analyzed in light of constructing basis function enfolded spaces. As a result, the concept of the chemical bond can transform into a collective functional structure, where one considers the whole set of molecular atoms plus enfolding centers as bearing the chemical bond in various collective forms.
... where the nature of the parameter will be discussed next. Due to previous work by one of us [14][15][16][17][18][19][20][21], one can associate one particle with such a Gaussian function. In this manner, the particle is described as a soft object instead of a hard point-like one. ...
Article
Full-text available
The present paper describes a quantum mechanical study of Cooper pairs from the point of view of Fermion pair correct spin. The basic idea of building the theory consists of describing each particle with an appropriate Gaussian function, transforming them into a soft quantum mechanical object. From here, a new orthonormalized basis set with adequate symmetry is constructed, and then one can easily build the two-particle spin functions and the two-particle energies. As the particle energies become repulsive, one can add a harmonic oscillator term to stabilize the initial Hamiltonian expectation values. Results indicate that a way to extend the description of Cooper pairs to N Fermion particles becomes a straightforward consequence of the theory developed here.
... Due to previous work by one of us [14][15][16][17][18][19][20][21], one can associate one particle with such a Gaussian function. In this manner, the particle is described as a soft object instead of a hard point-like one. ...
Preprint
Full-text available
The present paper describes a quantum mechanical study of Cooper pairs from the point of view of Fermion pair correct spin. The basic idea of building the theory consists of describing each particle with an appropriate Gaussian function, transforming them into a soft quantum mechanical object. From here, a new orthonormalized basis set with adequate symmetry is constructed, and then one can easily build the two-particle spin functions and the two-particle energies. As the particle energies become repulsive, one can add a harmonic oscillator term to stabilize the initial Hamiltonian expectation values. Results indicate that a way to extend the description of Cooper pairs to N Fermion particles becomes a straightforward consequence of the theory developed here.
... The technique was using the first-order electronic density function of quantum systems, to establish comparisons between them and extract information about their properties. Along time the quantum similarity mathematical background evolved, see for example references [19][20][21] and extended his potential applications to the origin of QSPR, a set of techniques to obtain values of unknown molecular properties, and has been shown useful in molecular design, see for example references [22,23] and to discuss relevant physical problems as in reference [24]. The simplest way to obtain a quantum similarity measure related to pairs of molecular structures, systems, or different states: {A, B} associated with a pair of density functions: { A , B } ∶ corresponds to computing an integral of the form: ...
Article
Full-text available
Three sets of exact solutions of the time-dependent Schrödinger equation of a particle that is trapped in a spherical box with a moving boundary wall have been calculated analytically. For these solutions, some physical quantities such as time-dependent average energy, average force, disequilibrium, quantum similarity measures as well as quantum similarity index have been investigated. Moreover, these solutions are compared concerning these physical quantities. The time-correlation functions among these solutions are investigated.
... Such behavior that can be associated with varied systems, from metallic plates up to swarms of particles, perhaps can be somehow connected with the Einstein-Podolski-Rosen paradox [11], via the present author works [12,13]. ...
Article
Full-text available
The Casimir effect is discussed via an HMO treatment. At this schematic theoretical level, the Casimir effect might be considered as the result of the general quantum mechanical interaction behavior of two sets of particles.
... The technique was using the first-order electronic density function of quantum systems, to establish comparisons between them and extract information about their properties. Along time the quantum similarity mathematical background evolved, see for example references [53][54][55] and extended his potential applications to the origin of QSPR, a set of techniques to obtain values of unknown molecular properties, and has been shown useful in molecular design, see for example references [56,57] and to discuss relevant physical problems as in reference [58]. The simplest way to obtain quantum similarity measures corresponds to computing an integral between a molecular pair {A, B} of density functions A ; B in the form of the integral: ...
Article
Full-text available
Exact solutions of time-dependent Schrödinger equation in presence of generalized Pöschl–Teller like potential plus oscillator potential are defined analytically with help of point transformation and separation of variables. The time-dependent average energy is expressed in terms of a dimensionless scale factor L of a quantum state with a time-dependent moving boundary condition. Moreover, quantum similarity measures and indices between two states are defined. Numerical values of rovibrational energy in presence and absence of centrifugal term, and average energy in absence of centrifugal term have been calculated for ten selected diatomic molecules: {H2{\text{H}}_{2}, LiH, HF, HCl, N2{\text{N}}_{2}, CO, SiO, O2{\text{O}}_{2}, F2{\text{F}}_{2}, NO}. In addition, the quantum similarity index between pairs of these selected molecules is calculated.
Article
Full-text available
In this work, we introduce the q-Rényi’s divergence, which results from the conjunction of Rényi’s divergence and Jackson’s integral. The resultant equation can be employed as a measure of chemical similarity, which consists of comparing two or more chemical species with a set of molecules that have been characterized to find two or more molecules that could have similar chemical or physical properties. To carry out our study, we applied q-Rényi’s divergence using a set of Tetrodotoxin variants and a set of 1641 organic molecules. Our results suggest that q-Rényi’s divergence could be a valuable tool to complement chemical similarity studies.
Article
Full-text available
This paper discusses the enfolding of the N-dimensional Euclidean space through N-dimensional spheres. The objective is to construct a framework that can be associated with space in the company of time. To arrive at this purpose, it is suggested that the properties of the Euclidean norms and modules of the vectors, which can be considered with origin in some space point and ending into a spherical surface, might be associated with a time-like representation that can enfold any space point. In this manner, an existing particle can be associated with a time-like sphere, and any object, lying in an arbitrary space point, can be associated with one or of several component time-like spheres. Even the Universe can be connected to one time-like sphere. Therefore, in the 3-dimensional Euclidean space where particles and objects exist one can talk about the structure of a time foam.
Article
Full-text available
The present paper uses the LCAO MO theory formalism. The structure of the first order electronic density function is decomposed in two kinds of quantum polyhedra to discuss the behavior of quantum atomic populations. Among the many aspects one can consider about atomic populations here, the quantum mechanical structure of the density function is taken as the most important characteristic to think about. Apart of the usual one-electron basis set, centered in the molecular atoms, there is also discussed the possibility that the three-dimensional space where the molecular structures are described can be also the site of basis functions centered in points non-coincident with atomic positions.
Article
Full-text available
Quantum key distribution (QKD)1–3 is a theoretically secure way of sharing secret keys between remote users. It has been demonstrated in a laboratory over a coiled optical fibre up to 404 kilometres long4–7. In the field, point-to-point QKD has been achieved from a satellite to a ground station up to 1,200 kilometres away8–10. However, real-world QKD-based cryptography targets physically separated users on the Earth, for which the maximum distance has been about 100 kilometres11,12. The use of trusted relays can extend these distances from across a typical metropolitan area13–16 to intercity¹⁷ and even intercontinental distances¹⁸. However, relays pose security risks, which can be avoided by using entanglement-based QKD, which has inherent source-independent security19,20. Long-distance entanglement distribution can be realized using quantum repeaters²¹, but the related technology is still immature for practical implementations²². The obvious alternative for extending the range of quantum communication without compromising its security is satellite-based QKD, but so far satellite-based entanglement distribution has not been efficient²³ enough to support QKD. Here we demonstrate entanglement-based QKD between two ground stations separated by 1,120 kilometres at a finite secret-key rate of 0.12 bits per second, without the need for trusted relays. Entangled photon pairs were distributed via two bidirectional downlinks from the Micius satellite to two ground observatories in Delingha and Nanshan in China. The development of a high-efficiency telescope and follow-up optics crucially improved the link efficiency. The generated keys are secure for realistic devices, because our ground receivers were carefully designed to guarantee fair sampling and immunity to all known side channels24,25. Our method not only increases the secure distance on the ground tenfold but also increases the practical security of QKD to an unprecedented level.
Article
Full-text available
Among the different platforms for quantum information processing, individual electron spins in semiconductor quantum dots stand out for their long coherence times and potential for scalable fabrication. The past years have witnessed substantial progress in the capabilities of spin qubits. However, coupling between distant electron spins, which is required for quantum error correction, presents a challenge, and this goal remains the focus of intense research. Quantum teleportation is a canonical method to transmit qubit states, but it has not been implemented in quantum-dot spin qubits. Here, we present evidence for quantum teleportation of electron spin qubits in semiconductor quantum dots. Although we have not performed quantum state tomography to definitively assess the teleportation fidelity, our data are consistent with conditional teleportation of spin eigenstates, entanglement swapping, and gate teleportation. Such evidence for all-matter spin-state teleportation underscores the capabilities of exchange-coupled spin qubits for quantum-information transfer.
Article
Full-text available
The concept of Fuzzy Hypercube is defined as a simple trigonometric extension of the binary structure of an N-dimensional Boolean hypercube. Moreover, in the present study, there is a discussion on the possibility of defining Fuzzy Hypercubes as a set of 2N2N 2^{N} vertices, which remain Stationary or might undergo Synchronous or Asynchronous evolution. Finally, the connection of Fuzzy Hypercubes with multivariate discrete probability distributions is also considered.
Article
Full-text available
The double slit experiment involving one quantum object is described from the point of view of a Gaussian space enfolding via a Gaussian particle density function in connection with Hückel MO (HMO) theory. The relation between the double slit experiment and HMO is made in such a way that it facilitates the schematic description of multiple slit experiments, permitting the analysis of the nature of the experiment, observable in the form of a generated density function.
Article
Full-text available
Bell's theorem can be refuted by presenting a counterexample which predicts correctly the expectation values of QM. As Bell has only ruled out noncontextual models a contextual model with hidden variables would refute his theorem. Such a model is presented able to explain the spin measurement results with entangled photons or electrons. It is not ruled out by the Kochen-Specker Theorem. Consequences for the feasibility of quantum computers are discussed. PACS: 03.65.Ta, 03.65.Ud Introduction 'Bell's Theorem is the collective name for a family of results, all showing the impossibility of a Local Realistic interpretation of quantum mechanics.' See Shamony [1] who gives a good overview of the state of the discussion about Bell's Theorem which was introduced in 1964 by the Irish physicist. In his paper "On the Einstein Podolsky Rosen Paradox" [2] he had developed the famous Bell inequality which any hidden variable theory describing entangled states has to obey in contrast to quantum mechanics (QM) which infringes that inequality. The inequality is a relation between expectation values of measurements taken at different settings of the instruments. A general approach to Logical Bell Inequalities and their relation to contextual models is given by [3]. Bell's paper and many subsequent experiments [4] having proved the infringement of Bell's inequality by QM established the belief of many physicists that nature was nonlocal [5]. The theory of relativity would not be violated because no information transport over the quantum channel of entangled photons [6] is possible.
Article
Full-text available
In this study, several simple aspects associated with the periodic table (PT) of the elements are commented. First, the connection of the PT with the structure of a seven‐dimensional Boolean hypercube leads afterward to discuss the nature of those PT elements bearing prime atomic numbers. Second, the use of quantum similarity (QS) to obtain an alternative insight on the PT element relations will be also developed. The foundation of the second part starts admitting that any element of the PT can be attached to a schematic electronic density function, constructed with a single Gaussian function: a Gaussian atomic density function, allowing to consider the PT elements as a set of quantum objects, and permits a straightforward construction of a QS matrix. Such QS scheme can be applied to the whole PT or to any subset of it. Manipulation of the QS matrices attached to any quantum object set allows the evaluation of statistical‐like values, acting as coordinates to numerically or graphically represent the chosen PT atomic element sets. © 2019 Wiley Periodicals, Inc. This article is intended to explore several not yet studied aspects of the periodic table (PT). A first part analyzes the presence of prime atomic numbers in the PT and tries to find some significance when observing the atoms with such a property. In a second part, relationship between the elements of the PT is established in terms of quantum similarity (QS) framework. For any set of elements of the PT, a simple QS matrix is obtained using, for each involved atom, a normalized Gaussian density function. From the QS matrix, a triad of coordinates might be calculated, permitting the 3D plotting of atomic sets, thus allowing a graphical representation of the PT and, therefore, providing visual comparison of the involved atomic sets.
Chapter
Full-text available
In this chapter, molecular quantum similarity (QS) measures involving three density functions are studied, providing the necessary algorithms and programming sources for application purposes. Triple density representation of some known molecular quantum object set (MQOS) permits to express each element as a symmetric matrix with dimension equal to the MQOS cardinality. Such matrix formulation appears instead of the vector representations founded on double density QS (DDQS) measures or as a result of the usual classical descriptor parameterization. The whole triple density quantum similarity (TDQS) measures description of a given MQOS corresponds to a third order hypervector or tensor, whose elements are symmetric matrix representations of every molecular structure belonging to the MQOS. Such tensorial representation permits to set up an extended set of procedures in order to study the relationships between the MQOS elements, beyond the usual vector description. For the sake of completeness the quantum mechanical origin of the TDQS integrals is sketched as an introduction. The three p-type Gaussian orbitals are employed along the theoretical development to illustrate, via a concrete and particularly simple case example, the structure of the definitions encountered along the discussion, as well as the ability of QS measures to discriminate between DF belonging to degenerate wave functions. The present study can be considered in this way a first step towards the general theory and computational feasibility of a hypermatricial or tensorial representation of molecular structures associated to any MQOS. Generalized Carbö similarity indices (CSI) are also studied as a way to manipulate the TDQS measures for easy interpretation. Besides the appropriate description of the programs associated to this chapter, here are given several application examples, based essentially on the same background philosophy as the usual DDQS measures of previous papers.
Article
Full-text available
In a quantum universe with a strong arrow of time, we postulate a low-entropy boundary condition (the Past Hypothesis) to account for the temporal asymmetry. In this paper, I show that the Past Hypothesis also contains enough information to simplify the quantum ontology and define a unique initial condition in such a world. First, I introduce Density Matrix Realism, the thesis that the quantum universe is described by a fundamental density matrix (a mixed state) that represents something objective. This stands in sharp contrast to Wave Function Realism, the thesis that the quantum universe is described by a wave function (a pure state) that represents something objective. Second, I suggest that the Past Hypothesis is sufficient to determine a unique and simple density matrix. This is achieved by what I call the Initial Projection Hypothesis: the initial density matrix of the universe is the normalized projection onto the special low-dimensional Hilbert space. Third, because the initial quantum state is unique and simple, we have a strong case for the \emph{Nomological Thesis}: the initial quantum state of the universe is on a par with laws of nature. This new package of ideas has several interesting implications, including on the harmony between statistical mechanics and quantum mechanics, the dynamic unity of the universe and the subsystems, and the alleged conflict between Humean supervenience and quantum entanglement.
Article
The Geometrization of Quantum Mechanics proposed in this work is based on the postulate that the quantum probability density can curve the classical spacetime. It is shown that the gravitational field produced by smearing a point-mass Mo at r=0 throughout all of space (in a spherically symmetric fashion) can be interpreted as the gravitational field generated by a self-gravitating anisotropic fluid droplet of mass density 4πMor2φ∗(r)φ(r) and which is sourced by the probability cloud (associated with a spinless point-particle of mass Mo) permeating a 3-spatial domain region D3=∫4πr2dr at any time t. Classically one may smear the point mass in any way we wish leading to arbitrary density configurations ρ(r). However, Quantum Mechanically this is not the case because the radial mass configuration M(r) must obey a key third order nonlinear differential equation (nonlinear extension of the Klein–Gordon equation) displayed in this work and which is the static spherically symmetric relativistic analog of the Newton–Schrödinger equation. We conclude by extending our proposal to the Lagrange–Finsler and Hamilton–Cartan geometry of (co) tangent spaces and involving the relativistic version of Bohm’s Quantum Potential. By further postulating that the quasi-probability Wigner distribution W(x,p) curves phase spaces, and by encompassing the Finsler-like geometry of the cotangent-bundle with phase space quantum mechanics, one can naturally incorporate the noncommutative and non-local Moyal star product (there are also non-associative star products as well). To conclude, Phase Space is the arena where to implement the space–time–matter unification program. It is our belief this is the right platform where the quantization of spacetime and the quantization in spacetime will coalesce.