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المؤلفون: Daria Van Hende, Laurent Lemmens, Stijn De Baerdemacker, Dimitri Van Neck, Patrick Bultinck, Guillaume Acke
المصدر: JOURNAL OF COMPUTATIONAL CHEMISTRY
مصطلحات موضوعية: Chemistry, Maximum Probability Domain Partitions, Computational Mathematics, Hubbard model, DEFINITION, Clar's rule, NESTED SUMMATION SYMBOLS, aromaticity, General Chemistry, HYDROCARBONS, QUANTUM-CHEMICAL APPLICATIONS, INDEX, DIELS-ALDER REACTIVITY
وصف الملف: application/pdf
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المؤلفون: Daria, Tolstykh, Laurent, Lemmens, Stijn, De Baerdemacker, Dimitri, Van Neck, Patrick, Bultinck, Guillaume, Acke
المصدر: Journal of computational chemistryREFERENCES. 43(7)
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3دورية أكاديمية
المصدر: SciPost Physics, Vol 3, Iss 4, p 028 (2017)
وصف الملف: electronic resource
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المؤلفون: Paul A. Johnson, Paul W. Ayers, Stijn De Baerdemacker, Peter A. Limacher, Dimitri Van Neck
المصدر: Computational and Theoretical Chemistry. 1212:113718
مصطلحات موضوعية: Chemical Physics (physics.chem-ph), Physics - Chemical Physics, FOS: Physical sciences, Physical and Theoretical Chemistry, Condensed Matter Physics, Biochemistry
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المصدر: SciPost Chemistry. 1
مصطلحات موضوعية: Chemical Physics (physics.chem-ph), Physics, Strongly Correlated Electrons (cond-mat.str-el), 010304 chemical physics, FOS: Physical sciences, chemistry.chemical_element, Molecular systems, Quantum number, 01 natural sciences, Symmetry (physics), Condensed Matter - Strongly Correlated Electrons, Neon, chemistry, Unpaired electron, Seniority (financial), Physics - Chemical Physics, Quantum mechanics, 0103 physical sciences, Physics::Atomic and Molecular Clusters, Tensor, 010306 general physics, Wave function
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::5f516eab11918dfdd039c3eadf4c2816
https://doi.org/10.21468/scipostchem.1.1.001 -
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المؤلفون: Stijn De Baerdemacker, Paul A. Johnson, Patrick Bultinck, Marianne Gratton, Laurie Carrier, Samuel Cloutier, Charles-Émile Fecteau, Paul W. Ayers, Dimitri Van Neck, Peter A. Limacher, Frédéric Berthiaume
المصدر: JOURNAL OF CHEMICAL PHYSICS
مصطلحات موضوعية: General Physics and Astronomy, FOS: Physical sciences, 010402 general chemistry, 01 natural sciences, Schrödinger equation, symbols.namesake, Condensed Matter - Strongly Correlated Electrons, Quantum mechanics, Physics - Chemical Physics, 0103 physical sciences, Physical and Theoretical Chemistry, Physics::Chemical Physics, Wave function, Ansatz, Chemical Physics (physics.chem-ph), 010304 chemical physics, Geminal, Electronic correlation, Strongly Correlated Electrons (cond-mat.str-el), Configuration interaction, 0104 chemical sciences, Chemistry, Physics and Astronomy, symbols, Ground state, Hamiltonian (quantum mechanics)
وصف الملف: application/pdf
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7
المؤلفون: Paul A. Johnson, Stijn De Baerdemacker, Peter A. Limacher, Taewon David Kim, Patrick Bultinck, Farnaz Heidar-Zadeh, Paul W. Ayers, Michael Richer, Ramón Alain Miranda-Quintana, Dimitri Van Neck
المصدر: COMPUTATIONAL AND THEORETICAL CHEMISTRY
مصطلحات موضوعية: REDUCED, DIATOMIC-MOLECULES, SEPARATED PAIR APPROXIMATION, Antisymmetrized product of geminals, 01 natural sciences, Biochemistry, CONFIGURATION-INTERACTION METHOD, Many-body problem, Theoretical physics, Quantum mechanics, 0103 physical sciences, Composite quantum particles, ANTISYMMETRIZED PRODUCT, NONORTHOGONAL GEMINALS, GENERALIZED, Physics::Chemical Physics, Physical and Theoretical Chemistry, 010306 general physics, Wave function, Boson, 010304 chemical physics, Geminal, QUANTUM-MECHANICS, Chemistry, Electron pair, Antisymmetrized geminal power, Condensed Matter Physics, Physics and Astronomy, quasiparticles, Product (mathematics), Symmetry breaking and restoration, ELECTRON CORRELATION, Noncanonical, COMPOSITE-PARTICLES, MANY-BODY PROBLEM, DENSITY-MATRICES
وصف الملف: application/pdf
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المؤلفون: Frank Verstraete, Dimitri Van Neck, Klaas Gunst
المصدر: JOURNAL OF CHEMICAL THEORY AND COMPUTATION
مصطلحات موضوعية: Chemical Physics (physics.chem-ph), Physics, Strongly Correlated Electrons (cond-mat.str-el), 010304 chemical physics, Group (mathematics), FOS: Physical sciences, State (functional analysis), 01 natural sciences, Computer Science Applications, Tree (descriptive set theory), Condensed Matter - Strongly Correlated Electrons, Physics and Astronomy, Tensor (intrinsic definition), Physics - Chemical Physics, 0103 physical sciences, Homogeneous space, Molecular symmetry, MATRIX RENORMALIZATION-GROUP, Condensed Matter::Strongly Correlated Electrons, Physical and Theoretical Chemistry, Abelian group, Special unitary group, Mathematical physics
وصف الملف: application/pdf
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المؤلفون: Akihiro Shimizu, Sebastian Wouters, Thomas Junkers, Michel Waroquier, Dimitri Van Neck, Veronique Van Speybroeck, Saron Catak, Benoît Champagne, Jelena D. Nikolic, Julia Romanova, Dirk Vanderzande
المصدر: Chemistry: A European Journal. 21(52):19176-19185
مصطلحات موضوعية: Chain propagation, Diradical, Chemistry, Radical, Organic Chemistry, Radical polymerization, Poly(p-phenylene vinylene), General Chemistry, Photochemistry, Chain termination, radicals, Catalysis, chemistry.chemical_compound, reaction mechanisms, Monomer, Polymerization, Computational chemistry, polymerization, density functional calculations, diradicals
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المؤلفون: Brecht Verstichel, Mario Van Raemdonck, Luis Lain, Alicia Torre, Dimitri Van Neck, Patrick Bultinck, Diego Ricardo Alcoba, Gustavo E. Massaccesi, Stijn De Baerdemacker, Ward Poelmans
المصدر: Journal of Chemical Theory and Computation. 11:4064-4076
مصطلحات موضوعية: Density matrix, Physics, Hilbert space, Hartree–Fock method, Renormalization group, Configuration interaction, Computer Science Applications, symbols.namesake, Quantum mechanics, symbols, Slater determinant, Symmetry breaking, Physical and Theoretical Chemistry, Wave function