Functional <i>N</i>-Representability in 2-Matrix, 1-Matrix, and Density Functional Theories

Journals Menu

Follow SCIRP

	+1 323-425-8868
	customer@scirp.org
	+86 18163351462(WhatsApp)
	1655362766

	Paper Publishing WeChat

Journal of Modern Physics

ISSN Print: 2153-1196
ISSN Online: 2153-120X
www.scirp.org/journal/jmp
E-mail: jmp@scirp.org

Google-based Impact Factor: 0.86
Citations h5-index & Ranking

Journals Menu

"Functional N-Representability in 2-Matrix, 1-Matrix, and Density Functional Theories"
written by Eduardo V. Ludeña, F. Javier Torres, Cesar Costa,
published by Journal of Modern Physics, Vol.4 No.3A, 2013

has been cited by the following article(s):

Google Scholar
CrossRef

[1]	Exploiting the nearsightedness principle within the framework of the anti‐Hermitian contracted Schrödinger equation
	… Journal of Quantum …, 2022

[2]	Levy-Lieb embedding of density-functional theory and its quantum kernel: Illustration for the Hubbard dimer using near-term quantum algorithms
	Physical Review A, 2022

[3]	Variational determination of the two-electron reduced density matrix within the doubly occupied configuration interaction framework: Treatments of triplet N-electron …
	The Journal of …, 2022

[4]	Variational determination of ground and excited-state two-electron reduced density matrices in the doubly occupied configuration space: A dispersion operator …
	2021

[5]	Funcionales de orbitales naturales: Teoría, Implementación y Aplicaciones
	2021

[6]	Global natural orbital functional: Towards the complete description of the electron correlation
	Physical Review Letters, 2021

[7]	Development and applications of natural orbital functional theory
	2020

[8]	Variational determination of the two-electron reduced density matrix within the doubly occupied configuration interaction scheme: An extension to the study of open …
	2020

[9]	DoNOF: an open-source implementation of natural-orbital-functional-based methods for quantum chemistry
	2020

[10]	Natural orbital functional for spin-polarized periodic systems
	2019

[11]	Advances in approximate natural orbital functional theory
	2019

[12]	New approach to obtain the analytical expression of the energy functional in free or confined atoms
	2019

[13]	The electron pairing approach in natural orbital functional theory
	2018

[14]	Phase dilemma in natural orbital functional theory from the N-representability perspective
	2018

[15]	Time-dependent pair density functional theory
	2018

[16]	Comment on “Generalization of the Kohn-Sham system that can represent arbitrary one-electron density matrices”
	2017

[17]	On the performance of Natural Orbital Functional Approximations in Hubbard model
	Journal of Physics: Condensed Matter, 2017

[18]	On the performance of natural orbital functional approximations in the Hubbard model
	2017

[19]	PNOF5 calculations based on the “thermodynamic fragment energy method”:\ mathrm {C} _ {n}\ mathrm {H} _ {2n+ 2}(n= 1, 10) and\ mathrm {(FH)} _ {n}(n= 1, 8) as test …
	Péter R. Surján, 2016

[20]	Estudio de Condiciones que Garantizan la N-Representabilidad en la Teoría del Funcional de la Densidad para Temperaturas Finitas en el Ensamble Gran Canónico
	2016

[21]	PNOF5 calculations based on the “thermodynamic fragment energy method”: and as test cases
	2016

[22]	PNOF5 calculations based on the “thermodynamic fragment energy method”: CnH2n+2 (n = 1, 10) and (FH)n (n = 1, 8) as test cases
	2015

[23]	H4: A challenging system for natural orbital functional approximations
	2015

[24]	H $ _4 $: A Challenging System For Natural Orbital Functional Approximations
	arXiv preprint arXiv:1507.08244, 2015

[25]	Chemical and ionization potentials: Relation via the Pauli potential and NOF theory
	International Journal of Quantum Chemistry, 2015

[26]	PNOF5 calculations based on the “thermodynamic fragment energy method”: C n H2n+ 2 (n= 1, 10) and (FH) n (n= 1, 8) as test cases
	Theoretical Chemistry Accounts, 2015

[27]	Energy dependence with the number of particles: Density and reduced density matrices functionals
	Chemical Physics Letters, 2014

[28]	Two new constraints for the cumulant matrix
	The Journal of chemical physics, 2014

[29]	Assessment of the second-order perturbative corrections to PNOF5
	Molecular Physics, 2014

[30]	Natural orbital functional calculations of molecular polarizabilities and second hyperpolarizabilities. The hydrogen molecule as a test case
	Journal of Physics B: Atomic, Molecular and Optical Physics, 2014

[31]	Perspective on natural orbital functional theory
	International Journal of Quantum Chemistry, 2014

[32]	Interacting pairs in natural orbital functional theory
	The Journal of chemical physics, 2014

[33]	The intrapair electron correlation in natural orbital functional theory
	The Journal of chemical physics, 2013

[34]	Interpair electron correlation by second-order perturbative corrections to PNOF5
	The Journal of chemical physics, 2013

[1]	Time evolution of natural orbitals in ab initio molecular dynamics The Journal of Chemical Physics, 2024 DOI:10.1063/5.0188491

[2]	Outstanding improvement in removing the delocalization error by global natural orbital functional The Journal of Chemical Physics, 2023 DOI:10.1063/5.0137378

[3]	Electron Correlation in the Iron(II) Porphyrin by Natural Orbital Functional Approximations Journal of Chemical Theory and Computation, 2023 DOI:10.1021/acs.jctc.2c01093

[4]	Outstanding improvement in removing the delocalization error by global natural orbital functional The Journal of Chemical Physics, 2023 DOI:10.1063/5.0137378

[5]	Electron Correlation in the Iron(II) Porphyrin by Natural Orbital Functional Approximations Journal of Chemical Theory and Computation, 2023 DOI:10.1021/acs.jctc.2c01093

[6]	Electron Correlation in the Iron(II) Porphyrin by Natural Orbital Functional Approximations Journal of Chemical Theory and Computation, 2023 DOI:10.1021/acs.jctc.2c01093

[7]	Exploiting the nearsightedness principle within the framework of the anti‐Hermitian contracted Schrödinger equation International Journal of Quantum Chemistry, 2022 DOI:10.1002/qua.26862

[8]	Variational determination of the two-electron reduced density matrix within the doubly occupied configuration interaction framework: Treatments of triplet N-electron systems The Journal of Chemical Physics, 2022 DOI:10.1063/5.0088125

[9]	Levy-Lieb embedding of density-functional theory and its quantum kernel: Illustration for the Hubbard dimer using near-term quantum algorithms Physical Review A, 2022 DOI:10.1103/PhysRevA.106.042807

[10]	Variational determination of the two-electron reduced density matrix within the doubly occupied configuration interaction framework: Treatments of triplet N-electron systems The Journal of Chemical Physics, 2022 DOI:10.1063/5.0088125

[11]	Variational determination of ground and excited-state two-electron reduced density matrices in the doubly occupied configuration space: A dispersion operator approach The Journal of Chemical Physics, 2021 DOI:10.1063/5.0051793

[12]	DoNOF: An open-source implementation of natural-orbital-functional-based methods for quantum chemistry Computer Physics Communications, 2021 DOI:10.1016/j.cpc.2020.107651

[13]	Variational determination of ground and excited-state two-electron reduced density matrices in the doubly occupied configuration space: A dispersion operator approach The Journal of Chemical Physics, 2021 DOI:10.1063/5.0051793

[14]	Global Natural Orbital Functional: Towards the Complete Description of the Electron Correlation Physical Review Letters, 2021 DOI:10.1103/PhysRevLett.127.233001

[15]	Variational determination of the two-electron reduced density matrix within the doubly occupied configuration interaction scheme: An extension to the study of open-shell systems The Journal of Chemical Physics, 2020 DOI:10.1063/5.0020581

[16]	Variational determination of the two-electron reduced density matrix within the doubly occupied configuration interaction scheme: An extension to the study of open-shell systems The Journal of Chemical Physics, 2020 DOI:10.1063/5.0020581

[17]	State of The Art of Molecular Electronic Structure Computations: Correlation Methods, Basis Sets and More Advances in Quantum Chemistry, 2019 DOI:10.1016/bs.aiq.2019.04.001

[18]	Natural orbital functional for spin-polarized periodic systems Journal of Physics: Condensed Matter, 2019 DOI:10.1088/1361-648X/ab0170

[19]	New approach to obtain the analytical expression of the energy functional in free or confined atoms Results in Physics, 2019 DOI:10.1016/j.rinp.2019.102261

[20]	Many-body Approaches at Different Scales 2018 DOI:10.1007/978-3-319-72374-7_22

[21]	Time-dependent pair density functional theory The European Physical Journal B, 2018 DOI:10.1140/epjb/e2018-90082-0

[22]	Phase dilemma in natural orbital functional theory from the N-representability perspective The European Physical Journal B, 2018 DOI:10.1140/epjb/e2018-90078-8

[23]	On the performance of natural orbital functional approximations in the Hubbard model Journal of Physics: Condensed Matter, 2017 DOI:10.1088/1361-648X/aa80ca

[24]	Comment on “Generalization of the Kohn-Sham system that can represent arbitrary one-electron density matrices” Physical Review A, 2017 DOI:10.1103/PhysRevA.96.046501

[25]	Chemical and ionization potentials: Relation via the Pauli potential and NOF theory International Journal of Quantum Chemistry, 2016 DOI:10.1002/qua.25039

[26]	Chemical and ionization potentials: Relation via the Pauli potential and NOF theory International Journal of Quantum Chemistry, 2016 DOI:10.1002/qua.25039

[27]	H4: A challenging system for natural orbital functional approximations The Journal of Chemical Physics, 2015 DOI:10.1063/1.4934799

[28]	PNOF5 calculations based on the “thermodynamic fragment energy method”: C n H2n+2 (n = 1, 10) and (FH) n (n = 1, 8) as test cases Theoretical Chemistry Accounts, 2015 DOI:10.1007/s00214-015-1756-x

[29]	H4: A challenging system for natural orbital functional approximations The Journal of Chemical Physics, 2015 DOI:10.1063/1.4934799

[30]	Two new constraints for the cumulant matrix The Journal of Chemical Physics, 2014 DOI:10.1063/1.4903449

[31]	Interacting pairs in natural orbital functional theory The Journal of Chemical Physics, 2014 DOI:10.1063/1.4890653

[32]	Natural orbital functional calculations of molecular polarizabilities and second hyperpolarizabilities. The hydrogen molecule as a test case Journal of Physics B: Atomic, Molecular and Optical Physics, 2014 DOI:10.1088/0953-4075/47/1/015101

[33]	Assessment of the second-order perturbative corrections to PNOF5 Molecular Physics, 2014 DOI:10.1080/00268976.2013.854933

[34]	Two new constraints for the cumulant matrix The Journal of Chemical Physics, 2014 DOI:10.1063/1.4903449

[35]	Perspective on natural orbital functional theory International Journal of Quantum Chemistry, 2014 DOI:10.1002/qua.24663

[36]	Energy dependence with the number of particles: Density and reduced density matrices functionals Chemical Physics Letters, 2014 DOI:10.1016/j.cplett.2013.12.071

[37]	Interacting pairs in natural orbital functional theory The Journal of Chemical Physics, 2014 DOI:10.1063/1.4890653

[38]	Perspective on natural orbital functional theory International Journal of Quantum Chemistry, 2014 DOI:10.1002/qua.24663

[39]	Interpair electron correlation by second-order perturbative corrections to PNOF5 The Journal of Chemical Physics, 2013 DOI:10.1063/1.4817946

[40]	The intrapair electron correlation in natural orbital functional theory The Journal of Chemical Physics, 2013 DOI:10.1063/1.4844075

[41]	The intrapair electron correlation in natural orbital functional theory The Journal of Chemical Physics, 2013 DOI:10.1063/1.4844075

[42]	Interpair electron correlation by second-order perturbative corrections to PNOF5 The Journal of Chemical Physics, 2013 DOI:10.1063/1.4817946

Follow SCIRP

	+1 323-425-8868
	customer@scirp.org
	+86 18163351462(WhatsApp)
	1655362766

	Paper Publishing WeChat

Journal of Modern Physics

Journal of Modern Physics

Journals Menu

Home

About SCIRP

Service

Policies