Determination of conformational energy differences of propynlidyne isomers using the effective valence shell Hamiltonian method

Journal of Chemical Physics

Volumn 112, Issue 21, 2000, Pages 9301-9309

  Chaudhuri, Rajat K ^b   Majumder, Sonjoy ^b   Freed, Karl F ^a  

^a UNIVERSITY OF CHICAGO   (United States)

^b INDIAN INSTITUTE OF ASTROPHYSICS   (India)

Author keywords

[No Author keywords available]

Indexed keywords

CARBON INORGANIC COMPOUNDS; COMPUTATIONAL METHODS; EIGENVALUES AND EIGENFUNCTIONS; GROUND STATE; IONIZATION; MOLECULAR VIBRATIONS; PARTIAL DIFFERENTIAL EQUATIONS; PERTURBATION TECHNIQUES;

CONFORMATIONAL ENERGY; HARMONIC VIBRATIONAL FREQUENCY; PROPYNLIDYNE ISOMER; SHELL HAMILTONIAN METHOD;

ISOMERS;

EID: 0033691643     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.481551     Document Type: Article

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