화학공학소재연구정보센터
검색결과 : 7건
No. Article
1 Ab initio potential-energy surfaces for the (X)over-tilde B-2(1), (A)over-tilde (2)A(1), and (B)over-tilde B-2(2) states of the H2S+ molecular ion
Hirst DM
Journal of Chemical Physics, 118(20), 9175, 2003
2 Ab initio potential energy surfaces for excited states of the NO2+ molecular ion and for the reaction of N+ with O-2
Hirst DM
Journal of Chemical Physics, 115(20), 9320, 2001
3 Ab initio study of the reaction of NO3 with the OH radical
Jitariu LC, Hirst DM
Journal of Physical Chemistry A, 103(33), 6673, 1999
4 Protonated ozone: Structure, energetics, and nonadiabatic effects
Ceotto M, Gianturco FA, Hirst DM
Journal of Physical Chemistry A, 103(48), 9984, 1999
5 Multireference Configuration-Interaction Calculations of Electronic States of N-Methylformamide, Acetamide, and N-Methylacetamide
Hirst JD, Hirst DM, Brooks CL
Journal of Physical Chemistry A, 101(26), 4821, 1997
6 Ab-Initio Calculations of the Excited-States of Formamide
Hirst JD, Hirst DM, Brooks CL
Journal of Physical Chemistry, 100(32), 13487, 1996
7 Photodissociation Pathways and Conical Intersections in the Low-Lying Electronic States of Sih2+
Mort SP, Jennings NA, Balintkurti GG, Hirst DM
Journal of Chemical Physics, 101(12), 10576, 1994