Relating normal vibrational modes to local vibrational modes with the help of an adiabatic connection scheme.
about
Chiral discrimination by vibrational spectroscopy utilizing local modes.C2 in a Box: Determining Its Intrinsic Bond Strength for the X(1)Σg(+) Ground State.The intrinsic strength of the halogen bond: electrostatic and covalent contributions described by coupled cluster theory.Generalization of the Tolman electronic parameter: the metal-ligand electronic parameter and the intrinsic strength of the metal-ligand bond.Bonding trends across the series of tricarbonato-actinyl anions [(AnO2)(CO3)3]4- (An = U-Cm): the plutonium turn.Predicting kinetically unstable C-C bonds from the ground-state properties of a molecule.Correlating the vibrational spectra of structurally related molecules: A spectroscopic measure of similarity.Vibrational properties and bonding nature of Sb2Se3 and their implications for chalcogenide materials.Analytic second derivatives from auxiliary density perturbation theory.Effective representation of amide III, II, I, and A modes on local vibrational modes: Analysis of ab initio quantum calculation results.Examining the impact of harmonic correlation on vibrational frequencies calculated in localized coordinates.
P2860
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P2860
Relating normal vibrational modes to local vibrational modes with the help of an adiabatic connection scheme.
description
2012 nî lūn-bûn
@nan
2012 թուականի Օգոստոսին հրատարակուած գիտական յօդուած
@hyw
2012 թվականի օգոստոսին հրատարակված գիտական հոդված
@hy
2012年の論文
@ja
2012年論文
@yue
2012年論文
@zh-hant
2012年論文
@zh-hk
2012年論文
@zh-mo
2012年論文
@zh-tw
2012年论文
@wuu
name
Relating normal vibrational mo ...... n adiabatic connection scheme.
@ast
Relating normal vibrational mo ...... n adiabatic connection scheme.
@en
Relating normal vibrational mo ...... n adiabatic connection scheme.
@nl
type
label
Relating normal vibrational mo ...... n adiabatic connection scheme.
@ast
Relating normal vibrational mo ...... n adiabatic connection scheme.
@en
Relating normal vibrational mo ...... n adiabatic connection scheme.
@nl
prefLabel
Relating normal vibrational mo ...... n adiabatic connection scheme.
@ast
Relating normal vibrational mo ...... n adiabatic connection scheme.
@en
Relating normal vibrational mo ...... n adiabatic connection scheme.
@nl
P2093
P2860
P356
P1476
Relating normal vibrational mo ...... n adiabatic connection scheme.
@en
P2093
Dieter Cremer
Elfi Kraka
Robert Kalescky
P2860
P304
P356
10.1063/1.4747339
P407
P577
2012-08-01T00:00:00Z