POTENTIAL-ENERGY SURFACES FOR ROTATIONAL-EXCITATION OF CH3 PRODUCT IN PHOTODISSOCIATION OF CH3I

被引:100
作者
YABUSHITA, S
MOROKUMA, K
机构
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D O I
10.1016/0009-2614(88)85253-9
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
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页码:517 / 521
页数:5
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共 38 条
[31]   VIBRATIONAL ENERGY-DISTRIBUTION OF THE CH3 RADICAL PHOTODISSOCIATED FROM CH3L [J].
SHAPIRO, M ;
BERSOHN, R .
JOURNAL OF CHEMICAL PHYSICS, 1980, 73 (08) :3810-3817
[32]   PHOTOFRAGMENTATION AND MAPPING OF NUCLEAR WAVEFUNCTIONS [J].
SHAPIRO, M .
CHEMICAL PHYSICS LETTERS, 1981, 81 (03) :521-527
[33]   PHOTOFRAGMENTATION OF CH3L - VIBRATIONAL DISTRIBUTION OF THE CH3 FRAGMENT [J].
SPARKS, RK ;
SHOBATAKE, K ;
CARLSON, LR ;
LEE, YT .
JOURNAL OF CHEMICAL PHYSICS, 1981, 75 (08) :3838-3846
[34]   EMISSION-SPECTROSCOPY OF PHOTODISSOCIATING MOLECULES - A COLLINEAR MODEL FOR CH3I AND CD3I [J].
SUNDBERG, RL ;
IMRE, D ;
HALE, MO ;
KINSEY, JL ;
COALSON, RD .
JOURNAL OF PHYSICAL CHEMISTRY, 1986, 90 (21) :5001-5009
[35]   NONEMPIRICAL SPIN-ORBIT CALCULATION OF THE CH3I GROUND-STATE [J].
TADJEDDINE, M ;
FLAMENT, JP ;
TEICHTEIL, C .
CHEMICAL PHYSICS, 1987, 118 (01) :45-55
[36]   ANGULAR-DISTRIBUTION OF PHOTOPREDISSOCIATION FRAGMENTS FROM CH3I+ [J].
TADJEDDINE, M ;
BOUCHOUX, G ;
MALEGAT, L ;
DURUP, J ;
PERNOT, C ;
WEINER, J .
CHEMICAL PHYSICS, 1982, 69 (1-2) :229-246
[37]  
VANVEEN GNA, 1984, CHEM PHYS, V87, P105
[38]   ABINITIO EFFECTIVE CORE POTENTIALS FOR MOLECULAR CALCULATIONS - POTENTIALS FOR MAIN GROUP ELEMENTS NA TO BI [J].
WADT, WR ;
HAY, PJ .
JOURNAL OF CHEMICAL PHYSICS, 1985, 82 (01) :284-298