X-ray absorption spectra of water within a plane-wave Car-Parrinello molecular dynamics framework.
about
Are recent water models obtained by fitting diffraction data consistent with infrared/Raman and x-ray absorption spectra?Simulation of x-ray absorption near-edge spectra and x-ray fluorescence spectra of optically excited molecules.X-ray absorption signatures of the molecular environment in water and ice.Requirements of first-principles calculations of X-ray absorption spectra of liquid water.Electrons and Hydrogen-Bond Connectivity in Liquid Water
P2860
X-ray absorption spectra of water within a plane-wave Car-Parrinello molecular dynamics framework.
description
2004 nî lūn-bûn
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name
X-ray absorption spectra of wa ...... molecular dynamics framework.
@en
X-ray absorption spectra of wa ...... molecular dynamics framework.
@nl
type
label
X-ray absorption spectra of wa ...... molecular dynamics framework.
@en
X-ray absorption spectra of wa ...... molecular dynamics framework.
@nl
prefLabel
X-ray absorption spectra of wa ...... molecular dynamics framework.
@en
X-ray absorption spectra of wa ...... molecular dynamics framework.
@nl
P2860
P356
P1476
X-ray absorption spectra of wa ...... o molecular dynamics framework
@en
P2093
Matteo Cavalleri
Michael Odelius
P2860
P304
10065-10075
P356
10.1063/1.1807821
P407
P577
2004-11-01T00:00:00Z