화학공학소재연구정보센터
검색결과 : 5건
No. Article
1 NO affinities of S-nitrosothiols: A direct experimental and computational investigation of RS-NO bond dissociation energies
Lu JM, Wittbrodt JM, Wang K, Wen Z, Schlegel HB, Wang PG, Cheng JP
Journal of the American Chemical Society, 123(12), 2903, 2001
2 Unusually stable pyrazolate-bridged dialuminum complexes containing bridging methyl groups
Yu ZK, Wittbrodt JM, Heeg MJ, Schlegel HB, Winter CH
Journal of the American Chemical Society, 122(38), 9338, 2000
3 Structures, energetics, and transition states of the silicon-phosphorus compounds Si2PHn (n=7, 5, 3, 1). An ab initio molecular orbital study
Wittbrodt JM, Schlegel HB
Journal of Physical Chemistry A, 103(42), 8547, 1999
4 Ab initio study of the interaction of water with cluster models of the aluminum terminated (0001) alpha-aluminum oxide surface
Wittbrodt JM, Hase WL, Schlegel HB
Journal of Physical Chemistry B, 102(34), 6539, 1998
5 Some Reasons Not to Use Spin Projected Density-Functional Theory
Wittbrodt JM, Schlegel HB
Journal of Chemical Physics, 105(15), 6574, 1996