Investigation of the benzene-naphthalene and naphthalene-naphthalene potential energy surfaces: DFT/CCSD(T) correction scheme.
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A benchmark comparison of σ/σ and π/π dispersion: the dimers of naphthalene and decalin, and coronene and perhydrocoronene.Stacking interactions of Ni(acac) chelates with benzene: calculated interaction energies.Density functional theory study of the interaction of vinyl radical, ethyne, and ethene with benzene, aimed to define an affordable computational level to investigate stability trends in large van der Waals complexes.An efficient algorithm for the density-functional theory treatment of dispersion interactions.Naphthyl Thio- and Carba-xylopyranosides for Exploration of the Active Site of β-1,4-Galactosyltransferase 7 (β4GalT7).The benzene⋯naphthalene complex: A more challenging system than the benzene dimer for newly developed computational methods.MP2, DFT and DFT-D study of the dimers of diazanaphthalenes: a comparative study of their structures, stabilisation and binding energiesChelate ring stacking interactions in the supramolecular assemblies of Zn(ii)and Cd(ii) coordination compounds: a combined experimental and theoretical studyThe role of unconventional stacking interactions in the supramolecular assemblies of Hg(ii) coordination compounds
P2860
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P2860
Investigation of the benzene-naphthalene and naphthalene-naphthalene potential energy surfaces: DFT/CCSD(T) correction scheme.
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
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2008年學術文章
@zh-hant
name
Investigation of the benzene-n ...... tial energy surfaces: DFT/CCSD
@nl
Investigation of the benzene-n ...... DFT/CCSD(T) correction scheme.
@en
type
label
Investigation of the benzene-n ...... tial energy surfaces: DFT/CCSD
@nl
Investigation of the benzene-n ...... DFT/CCSD(T) correction scheme.
@en
prefLabel
Investigation of the benzene-n ...... tial energy surfaces: DFT/CCSD
@nl
Investigation of the benzene-n ...... DFT/CCSD(T) correction scheme.
@en
P356
P1433
P1476
Investigation of the benzene-n ...... DFT/CCSD(T) correction scheme.
@en
P2093
Miroslav Rubes
Ota Bludský
P304
P356
10.1002/CPHC.200800274
P577
2008-08-01T00:00:00Z