Arnoldi Algorithm for the Simulation of Multidimensional Infrared Spectroscopy

Bulletin of the Korean Chemical Society

Volumn 24, Issue 8, 2003, Pages 1097-1101

  Hayashi, Tomoyuki ^a   Mukamel, Shaul ^a  

^a UNIVERSITY OF ROCHESTER   (United States)

Author keywords

Arnoldi algorithm; Hydrogen bonding; Infrared spectroscopy; Malonaldehyde

Indexed keywords

MALONALDEHYDE;

ALGORITHM; ARTICLE; CALCULATION; CHEMICAL STRUCTURE; DENSITY FUNCTIONAL THEORY; FORCE; HYDROGEN BOND; INFRARED SPECTROSCOPY; NONLINEAR SYSTEM; VIBRATION;

EID: 0344875939     PISSN: 02532964     EISSN: None     Source Type: Journal    
DOI: 10.5012/bkcs.2003.24.8.1097     Document Type: Article

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