화학공학소재연구정보센터
검색결과 : 5건
No. Article
1 A linear response approach to second-order electronic transition intensities for multiconfigurational self-consistent field wave functions
Stalring J, Bernhardsson A, Malmqvist PA
Journal of Chemical Physics, 117(3), 1010, 2002
2 A theoretical study of the B-1(2u) and B-1(1u) vibronic bands in benzene
Bernhardsson A, Forsberg N, Malmqvist PA, Roos BO, Serrano-Andres L
Journal of Chemical Physics, 112(6), 2798, 2000
3 Infrared spectroscopic and ab initio study of HOOClO2
Svensson T, Nelander B, Bernhardsson A, Karlstrom G
Journal of Physical Chemistry A, 103(23), 4432, 1999
4 Benzyne thermochemistry: A benchmark ab initio study
Lindh R, Bernhardsson A, Schutz M
Journal of Physical Chemistry A, 103(48), 9913, 1999
5 Extended Ab-Initio and Theoretical Thermodynamics Studies of the Bergman Reaction and the Energy Splitting of the Singlet O-Benzynes, M-Benzynes, and P-Benzynes
Lindh R, Lee TJ, Bernhardsson A, Persson BJ, Karlstrom G
Journal of the American Chemical Society, 117(27), 7186, 1995