Range-separated density-functional theory with random phase approximation applied to noncovalent intermolecular interactions.
about
Third-order corrections to random-phase approximation correlation energies.Basis set convergence of molecular correlation energy differences within the random phase approximation.Equivalence of particle-particle random phase approximation correlation energy and ladder-coupled-cluster doubles.Spin-unrestricted random-phase approximation with range separation: Benchmark on atomization energies and reaction barrier heights.Improving the accuracy of ground-state correlation energies within a plane-wave basis set: The electron-hole exchange kernel.Random phase approximation with second-order screened exchange for current-carrying atomic states.Many-body dispersion effects in the binding of adsorbates on metal surfaces.Perspective: Advances and challenges in treating van der Waals dispersion forces in density functional theory.Self-consistent Kohn-Sham method based on the adiabatic-connection fluctuation-dissipation theorem and the exact-exchange kernel.Evaluating interaction energies of weakly bonded systems using the Buckingham-Hirshfeld method.Short-range second order screened exchange correction to RPA correlation energies.An assessment of the random-phase approximation functional and characteristics analysis for noncovalent cation-π interactions.Basis convergence of range-separated density-functional theory.Stability conditions for exact-exchange Kohn-Sham methods and their relation to correlation energies from the adiabatic-connection fluctuation-dissipation theorem.Random-phase approximation correlation energies from Lanczos chains and an optimal basis set: theory and applications to the benzene dimer.Efficient self-consistent treatment of electron correlation within the random phase approximation.Resolution of identity approach for the Kohn-Sham correlation energy within the exact-exchange random-phase approximation.Beyond the random-phase approximation for the electron correlation energy: the importance of single excitations.Benchmark calculations of the adsorption of aromatic molecules on graphene.Excitation energies along a range-separated adiabatic connection.Molecular bonding with the RPAx: From weak dispersion forces to strong correlationElectron correlation methods based on the random phase approximation
P2860
Q33921993-B0990637-C7D7-49A1-818E-411477B3F9D8Q34179861-A8CB58EF-7573-40C3-BA2D-8D613BA7503FQ34992343-FD669B2B-88D4-41EF-803E-01AFBDAA8289Q35612146-20B1734C-414D-4CE0-A10C-FFB994374DBBQ36135161-7169400B-7C01-4C18-8D23-924D0857453DQ36226887-B816CB8E-B5E8-42D3-9F69-412296D3FC52Q38587556-3498D1F4-D208-490B-B000-05421CB40B83Q39545434-EB56F140-730A-43F7-9043-AAEAC06E9529Q40777380-3DBB1A3B-D59E-4FC4-B90A-C26DC60FF5AFQ45121649-F77BB20F-CA8A-4254-A7D0-857A4964FE7EQ47341615-7C85574F-F77C-402A-96ED-495A2947AEC7Q47970150-F24DC1B6-3BC0-42EA-9EEF-EACA8C063F2BQ51006226-6EAD84E4-F3EF-4CAA-A0CF-CBE56302F6F4Q51007027-C020627D-08F7-4654-A496-BA0DCF23CB13Q51085213-86DD3948-1D1E-447A-B2EE-60CA325E5614Q51167304-A6872000-8E7C-454E-BF7F-7E363A031270Q51386509-A3A2B328-2D42-43C6-9F20-94A4EF074B3DQ52895589-2ADB11AA-B4FC-45BF-B2C6-A376C998FBA5Q53192071-30DE7612-4C9C-452C-8119-24881017E8BBQ53267038-320FB751-1911-42DA-B2A1-56CD42DB7799Q57614500-BC22BC4D-A3FB-4E4E-80DA-8683C5AA10B1Q58685523-C44BCC20-BCCC-4417-8AF0-D9A4BA6F53A4
P2860
Range-separated density-functional theory with random phase approximation applied to noncovalent intermolecular interactions.
description
2010 nî lūn-bûn
@nan
2010 թուականի Յունիսին հրատարակուած գիտական յօդուած
@hyw
2010 թվականի հունիսին հրատարակված գիտական հոդված
@hy
2010年の論文
@ja
2010年論文
@yue
2010年論文
@zh-hant
2010年論文
@zh-hk
2010年論文
@zh-mo
2010年論文
@zh-tw
2010年论文
@wuu
name
Range-separated density-functi ...... t intermolecular interactions.
@ast
Range-separated density-functi ...... t intermolecular interactions.
@en
type
label
Range-separated density-functi ...... t intermolecular interactions.
@ast
Range-separated density-functi ...... t intermolecular interactions.
@en
prefLabel
Range-separated density-functi ...... t intermolecular interactions.
@ast
Range-separated density-functi ...... t intermolecular interactions.
@en
P2093
P2860
P356
P1476
Range-separated density-functi ...... t intermolecular interactions.
@en
P2093
Andreas Savin
Julien Toulouse
János G Angyán
Wuming Zhu
P2860
P304
P356
10.1063/1.3431616
P407
P577
2010-06-01T00:00:00Z