RELATIVISTIC PSEUDOPOTENTIAL CALCULATIONS FOR HBR+, HBR, HBR-, HI+, HI, AND HI-

被引:23
作者
SCHWERDTFEGER, P
VONSZENTPALY, L
STOLL, H
PREUSS, H
机构
[1] UNIV STUTTGART, INST THEORET CHEM, D-7000 STUTTGART 80, GERMANY
[2] UNIV GUANAJUATO, FAC QUIM, GUANAJUATO GTO36000, MEXICO
关键词
D O I
10.1063/1.453597
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 ;
摘要
引用
收藏
页码:510 / 513
页数:4
相关论文
共 32 条
[1]   INVESTIGATION OF NEGATIVE-ION STATES IN HCL AND HF BY CONFIGURATION-INTERACTION METHODS [J].
BETTENDORFF, M ;
BUENKER, RJ ;
PEYERIMHOFF, SD .
MOLECULAR PHYSICS, 1983, 50 (06) :1363-1380
[2]  
BINKLEY JS, 1984, GAUSSIAN82
[3]  
BURROW PD, 1974, J PHYS B ATOM MOL PH, V7, P1385
[4]   DISSOCIATIVE ELECTRON ATTACHMENT TO HYDROGEN HALIDES AND THEIR DEUTERATED ANALOGS [J].
CHRISTOP.LG ;
COMPTON, RN ;
DICKSON, HW .
JOURNAL OF CHEMICAL PHYSICS, 1968, 48 (05) :1949-&
[5]   NEGATIVE IONS OF POLAR MOLECULES [J].
CRAWFORD, OH .
MOLECULAR PHYSICS, 1971, 20 (04) :585-&
[6]   ELECTRON CAPTURE PROCESSES IN THE HYDROGEN HALIDES [J].
FROST, DC ;
MCDOWELL, CA .
JOURNAL OF CHEMICAL PHYSICS, 1958, 29 (03) :503-506
[7]   A PROPER ACCOUNT OF CORE-POLARIZATION WITH PSEUDOPOTENTIALS - SINGLE VALENCE-ELECTRON ALKALI COMPOUNDS [J].
FUENTEALBA, P ;
PREUSS, H ;
STOLL, H ;
VONSZENTPALY, L .
CHEMICAL PHYSICS LETTERS, 1982, 89 (05) :418-422
[8]   ACCURATE AND EFFICIENT METHODS FOR EVALUATION OF VACUUM-POLARIZATION POTENTIALS OF ORDER ZALPHA AND ZALPHA2 [J].
FULLERTON, LW ;
RINKER, GA .
PHYSICAL REVIEW A, 1976, 13 (03) :1283-1287
[9]   COMMENT ON AB-INITIO GROUND-STATE POTENTIAL-ENERGY SURFACES FOR ANIONS OF POLAR-MOLECULES [J].
GARRETT, WR .
CHEMICAL PHYSICS LETTERS, 1979, 62 (02) :325-328
[10]  
GOLDSTEIN E, 1978, J CHEM PHYS, V68, P2713