Wavelet transform analysis of ab initio molecular dynamics simulation: Application to core-excitation dynamics of BF3

Journal of Computational Chemistry

Volumn 28, Issue 6, 2007, Pages 1137-1144

  Otsuka, Takao ^a   Nakai, Hiromi ^a  

^a WASEDA UNIVERSITY   (Japan)

Author keywords

Ab initio molecular dynamics; Continuous wavelet transform; Core excitation dynamics; Short time Fourier transform; Time frequency analysis

Indexed keywords

AUTOCORRELATION; COMPUTER SIMULATION; DEFORMATION; ELECTRIC EXCITATION; INFORMATION ANALYSIS; MOLECULAR DYNAMICS;

AB INITIO MOLECULAR DYNAMICS; CONTINUOUS WAVELET TRANSFORM; CORE-EXCITATION DYNAMICS; SHORT-TIME FOURIER TRANSFORM; TIME-FREQUENCY ANALYSIS;

WAVELET TRANSFORMS;

EID: 33947726675     PISSN: 01928651     EISSN: 1096987X     Source Type: Journal    
DOI: 10.1002/jcc.20599     Document Type: Article

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