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A Gaussian holographic theorem and the projection of electronic density functions into the surface of a sphere
ArticleAbstract: A theorem, associated to the holographic nature of general Gaussian functions, is employed to descriPalabras claves:ASA density functions, Electronic density functions (EDF), Gaussian holographic theorem, Projection of EDF into spherical surfacesAutores:Besalu E., Ramón Carbö-D̈orcaFuentes:scopusA discussion on the Einstein-Podolski-Rosen (EPR) effect in a unique wavefunction quantum mechanical framework
ArticleAbstract: A unique wavefunction, constructed according to the original Einstein-Podolski-Rosen (EPR) descriptiPalabras claves:Einstein-Podolski-Rosen paradox, expectation values, Inward matrix product, Selectors, Wavefunction structureAutores:Ramón Carbö-D̈orcaFuentes:scopusA general multiconfiguration paired excitation self-consistent field theory (MC PE SCF)
ArticleAbstract: A multiconfigurational paired excitation SCF (MC PE SCF) framework is described, in an attempt to gePalabras claves:Autores:Hernández J.A., Ramón Carbö-D̈orcaFuentes:scopusA general survey of molecular quantum similarity
ArticleAbstract: A comprehensive survey of the theoretical foundations and definitions associated with quantum similaPalabras claves:Atomic shell approximation, Convex sets, Definite positive operators, Density functions, discrete molecular representation, QSAR, QSPR, Quantum objects, Quantum similarity measures and indices, Similarity matrices, Tagged sets, vector semispacesAutores:Besalu E., Ramón Carbö-D̈orcaFuentes:scopusA new insight on the quantum quantitative structure-properties relationships
Conference ObjectAbstract: The theoretical basis of quantum Quantitative Structure-Properties Relationship (QSPR) is analyzed.Palabras claves:Cramer steroids, Fundamental QQSPR equation, QQSPR algorithms, QQSPR operators, quantum QSPR, Quantum SimilarityAutores:Ramón Carbö-D̈orca, Van Damme S.Fuentes:scopusA postulate involving quantum mechanical momentum in position space, density function expression of the kinetic energy and Heisenberg's uncertainty relation
ArticleAbstract: A postulate is enunciated involving the construction of the quantum mechanical linear momentum vectoPalabras claves:Atomic shell approximation density functions, Gaussian model density functions, Heisenberg's uncertainty, Kinetic energy, LCAO MO density functions, Momentum operator in position spaceAutores:Besalu E., Ramón Carbö-D̈orcaFuentes:scopusA procedure to obtain an accurate approximation to a full CI wavefunction
ArticleAbstract: Based on Jacobi elementary rotations, a simple, elegant procedure to obtain approximate CI wavefunctPalabras claves:Autores:Besalu E., Ramón Carbö-D̈orcaFuentes:scopusA quantum similarity discussion about Einstein–Podolsky–Rosen (EPR) paradox in Gaussian enfolded spaces
ArticleAbstract: The Einstein–Podolsky–Rosen discussion about the completeness of quantum mechanics is examined usingPalabras claves:Einstein–Podolsky–Rosen (EPR) paradox, Gaussian enfolded spaces, Gaussian functions, Quantum density functions, Quantum polyhedra, Quantum Similarity, Variance of a quantum polyhedronAutores:Chang J., Ramón Carbö-D̈orcaFuentes:scopusA quantum similarity matrix (QSM) Aufbau procedure
ArticleAbstract: An Aufbau recursive algorithm, leading to the construction of molecular Quantum similarity matricesPalabras claves:Quantum Similarity, Quantum similarity Aufbau condition, Quantum similarity matrices, Quantum similarity matrices Aufbau recursive constructionAutores:Ramón Carbö-D̈orcaFuentes:scopusCollective Euclidian distances and quantum similarity
ArticleAbstract: A simple algorithm to find out a collective distance between arbitrary assemblies of points in somePalabras claves:Carbó similarity index, Collective Euclidian distances, Distance, Euclidian distances, Gram matrices, Quantum dissimilarity indices, Quantum SimilarityAutores:Ramón Carbö-D̈orcaFuentes:scopus