Time-dependent quantum study of the HCN → HNC isomerization

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Bibliographic Details
Published in:	Journal of physical chemistry (1952) Vol. 97; no. 48; pp. 12535 - 12540
Main Authors:	BOON LEONG LAN, BOWMAN, J. M
Format:	Conference Proceeding
Language:	English
Published:	Washington, DC American Chemical Society 02-12-1993
Subjects:	Chemistry Exact sciences and technology Inorganic chemistry and origins of life Kinetics and mechanism of reactions Ternary compound Bond length Ab initio method Eigenfunction Isomerization Theoretical study Cyanic acid Intermediate energy RRKM theory Wave packet Potential surface Kinetics Potential method Vibrational states Isocyanic acid Conformation
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Description
ISSN:	0022-3654 1541-5740
DOI:	10.1021/j100150a015