검색결과 : 5건
| No. | Article |
|---|---|
| 1 |
Modern valence-bond description of chemical reaction mechanisms : Diels-Alder reaction Karadakov PB, Cooper DL, Gerratt J Journal of the American Chemical Society, 120(16), 3975, 1998 |
| 2 |
Excited and Ionized States of Free-Base Porphin Studied by the Symmetry-Adapted Cluster-Configuration Interaction (Sac-CI) Method Nakatsuji H, Hasegawa JY, Hada M Journal of Chemical Physics, 104(6), 2321, 1996 |
| 3 |
A Complete Active Space Valence-Bond (Casvb) Method Hirao K, Nakano H, Nakayama K, Dupuis M Journal of Chemical Physics, 105(20), 9227, 1996 |
| 4 |
Highly Accurate Ab-Initio Pi-Electron Hamiltonians for Small Protonated Schiff-Bases Martin CH Journal of Physical Chemistry, 100(34), 14310, 1996 |
| 5 |
Excited-State Cis-Trans Isomerization of Cis-Hexatriene - A CAS-SCF Computational Study Olivucci M, Bernardi F, Celani P, Ragazos I, Robb MA Journal of the American Chemical Society, 116(3), 1077, 1994 |