Developing the random phase approximation into a practical post-Kohn-Sham correlation model.
about
Evolution of DFT studies in view of a scientometric perspectiveMoment expansion of the linear density-density response function.Correlation potentials for molecular bond dissociation within the self-consistent random phase approximation.Interatomic methods for the dispersion energy derived from the adiabatic connection fluctuation-dissipation theorem.The ground state correlation energy of the random phase approximation from a ring coupled cluster doubles approach.Long-range-corrected hybrids including random phase approximation correlation.Long-range-corrected hybrid density functionals including random phase approximation correlation: application to noncovalent interactions.A first-principles study of weakly bound molecules using exact exchange and the random phase approximation.The role of the reference state in long-range random phase approximation correlation.Fast computation of molecular random phase approximation correlation energies using resolution of the identity and imaginary frequency integration.Range-separated density-functional theory with random phase approximation applied to noncovalent intermolecular interactions.On the equivalence of ring-coupled cluster and adiabatic connection fluctuation-dissipation theorem random phase approximation correlation energy expressions.Power series expansion of the random phase approximation correlation energy: The role of the third- and higher-order contributions.A simple but fully nonlocal correction to the random phase approximation.Third-order corrections to random-phase approximation correlation energies.Increasing the applicability of density functional theory. II. Correlation potentials from the random phase approximation and beyond.Basis set convergence of molecular correlation energy differences within the random phase approximation.Van der Waals interactions between hydrocarbon molecules and zeolites: periodic calculations at different levels of theory, from density functional theory to the random phase approximation and Møller-Plesset perturbation theory.Equivalence of particle-particle random phase approximation correlation energy and ladder-coupled-cluster doubles.Benchmark tests and spin adaptation for the particle-particle random phase approximation.Communication: two-component ring-coupled-cluster computation of the correlation energy in the random-phase approximation.Restricted second random phase approximations and Tamm-Dancoff approximations for electronic excitation energy calculations.A computationally efficient double hybrid density functional based on the random phase approximation.Communication: An effective linear-scaling atomic-orbital reformulation of the random-phase approximation using a contracted double-Laplace transformation.Self-consistent Kohn-Sham method based on the adiabatic-connection fluctuation-dissipation theorem and the exact-exchange kernel.Communication: Almost error-free resolution-of-the-identity correlation methods by null space removal of the particle-hole interactions.Intramolecular halogen-halogen bonds?Regularized orbital-optimized second-order perturbation theory.Communication: explicitly-correlated second-order correction to the correlation energy in the random-phase approximation.Ions in solution: density corrected density functional theory (DC-DFT).Short-range second order screened exchange correction to RPA correlation energies.Embedding for bulk systems using localized atomic orbitals.The distinguishable cluster approach from a screened Coulomb formalism.Assessing Density Functionals Using Many Body Theory for Hybrid Perovskites.Singles correlation energy contributions in solids.Cubic-scaling algorithm and self-consistent field for the random-phase approximation with second-order screened exchange.Stability conditions for exact-exchange Kohn-Sham methods and their relation to correlation energies from the adiabatic-connection fluctuation-dissipation theorem.FDE-vdW: A van der Waals inclusive subsystem density-functional theory.Orbital-dependent second-order scaled-opposite-spin correlation functionals in the optimized effective potential method.Coupled cluster channels in the homogeneous electron gas.
P2860
Q27902323-A7E7455E-52B9-4B0E-8ECF-B7FEB919F032Q30315969-F618E5E0-8DFA-472F-B102-75FC30FAEBCBQ30318202-EB6D1732-BE9B-414E-9169-4AD86A0A0FC7Q31111810-CFCA0A0E-5C9E-4CA8-BF68-CDDF7B13C73AQ33395040-0E14A161-5021-439E-9869-294A8E5A6B60Q33414219-5332199F-4854-4989-9FEF-5C769C7E2E96Q33485433-13441965-6E28-4801-ABAF-5833E595724FQ33527499-09A040BD-CD61-402C-B591-FC0948F07364Q33612671-077BB7D8-38B5-4E4B-8E5F-30545267F495Q33613933-7E67C309-B842-493E-8AD5-634861055FC1Q33621590-B1B9438C-40ED-4C93-875B-86FDE0912692Q33725967-C5909733-CE3E-4D01-9D91-0A2C75815D7EQ33725973-8EB6A71C-6576-4E63-885E-89CDB1D94B5CQ33853133-185C879B-6148-4C43-963D-D34F8B4EE1E2Q33921993-FCC78340-726D-4E0C-9621-3E06B0D844D7Q34148903-801A3FF9-7A7D-4500-90DA-EAE81F82941BQ34179861-BDC53E80-C433-47B3-80E9-5E3A612C67F6Q34418765-8E4717D9-A7EF-4D7D-AF7E-FCC82B9CC4C1Q34992343-00916DB5-3945-4E6C-9742-7ADAE46F6BDEQ35037203-B48BFB51-5CDD-4B00-BA73-16DF33FA8952Q35062682-A4F02C0F-DD49-4719-88FE-8B7C2B860438Q35496195-12F7E761-1081-41FA-9D1F-7B476CDDC305Q35875798-7341DD0B-DF70-4E35-9051-1116406B341BQ35901951-AAB81BA8-E874-430D-9893-CC5C197097FEQ40777380-7FCA92C4-F013-4084-8DD5-04F2E727C257Q42216192-8F7AC038-B3CB-4B0C-BABC-F6CB69282EE6Q43759660-EA58864C-DFF4-4215-8985-9592B07EAF4FQ43899888-DEC54ADC-3C4E-46C9-B761-86FFA651BCC7Q44585601-60CA64F6-5D4E-49D0-91B7-4F081AB29C34Q46193948-A70E0204-5DEE-4EE2-A2AF-C8CA29E3AB61Q47341615-1966AEA0-CDF6-4683-A149-1B9A85C40507Q48057274-73EB918D-8088-43D0-B712-6A0B68B2AF34Q48692640-967C8193-DE9E-4681-B647-FE81235D61FAQ50101939-87F409FA-3E8C-4A49-8138-025D79C41AA6Q50853744-C14B6EA9-88A9-4BF2-B581-9D0361B1BFFFQ50865260-7D6105C5-ED5D-4136-9961-0E398444D992Q51007027-40B4E148-1DB8-4A74-B372-269122A95A9CQ51062408-C71E6D89-D88D-4923-900E-FACF9020EFD9Q51066939-E6CA057B-FA15-43CB-8F33-E71E3554996AQ51097497-66877512-9D5C-49EE-AE4D-0CC7840151F6
P2860
Developing the random phase approximation into a practical post-Kohn-Sham correlation model.
description
2008 nî lūn-bûn
@nan
2008年の論文
@ja
2008年学术文章
@wuu
2008年学术文章
@zh
2008年学术文章
@zh-cn
2008年学术文章
@zh-hans
2008年学术文章
@zh-my
2008年学术文章
@zh-sg
2008年學術文章
@yue
2008年學術文章
@zh-hant
name
Developing the random phase ap ...... t-Kohn-Sham correlation model.
@en
Developing the random phase ap ...... t-Kohn-Sham correlation model.
@nl
type
label
Developing the random phase ap ...... t-Kohn-Sham correlation model.
@en
Developing the random phase ap ...... t-Kohn-Sham correlation model.
@nl
prefLabel
Developing the random phase ap ...... t-Kohn-Sham correlation model.
@en
Developing the random phase ap ...... t-Kohn-Sham correlation model.
@nl
P2860
P356
P1476
Developing the random phase ap ...... t-Kohn-Sham correlation model.
@en
P2860
P304
P356
10.1063/1.2977789
P407
P577
2008-09-01T00:00:00Z