VALENCE BOND STUDIES ON NH3 AND PH3

被引:6
作者
MACLAGAN, RGAR
机构
关键词
D O I
10.1080/00268978000103671
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:1471 / 1481
页数:11
相关论文
共 21 条
[11]  
MACLAGAN RGA, 1977, MOL PHYS, V35, P1343
[12]   VALENCE-BOND STUDIES OF AH2 MOLECULES .2. MINIMAL STO BASIS SET CALCULATIONS ON H2O [J].
MACLAGAN, RGAR ;
SCHNUELLE, GW .
THEORETICA CHIMICA ACTA, 1977, 46 (03) :165-172
[13]   EINE VB-CI-BERECHNUNG DES AMMONIAKMOLEKULS [J].
MORAW, H .
ZEITSCHRIFT FUR NATURFORSCHUNG PART A-ASTROPHYSIK PHYSIK UND PHYSIKALISCHE CHEMIE, 1966, A 21 (12) :2062-&
[14]   INFLUENCE OF BASIS SET AND CONVERGENCE IN AB-INITIO VALENCE-BOND CALCULATIONS [J].
RAIMONDI, M ;
TANTARDINI, GF ;
SIMONETTA, M .
MOLECULAR PHYSICS, 1975, 30 (03) :797-808
[15]   AB-INITIO VALENCE BOND CALCULATIONS .4. H2S, SH AND RELATED IONS [J].
RAIMONDI, M ;
TANTARDINI, GF ;
SIMONETTA, M .
MOLECULAR PHYSICS, 1975, 30 (03) :703-712
[16]   ABINITIO INVESTIGATION OF GEOMETRY CHANGES DURING INVERSION OF NH3, NH2F, NHF2, NF3 AND PH3, PH2F, PHF2, PF3 [J].
SCHMIEDEKAMP, A ;
SKAARUP, S ;
PULAY, P ;
BOGGS, JE .
JOURNAL OF CHEMICAL PHYSICS, 1977, 66 (12) :5769-5770
[17]   ACCURATE SCF CALCULATION FOR AMMONIA AND ITS INVERSION MOTION [J].
STEVENS, RM .
JOURNAL OF CHEMICAL PHYSICS, 1971, 55 (04) :1725-&
[18]   CL CALCULATIONS FOR INVERSION BARRIER OF AMMONIA [J].
STEVENS, RM .
JOURNAL OF CHEMICAL PHYSICS, 1974, 61 (05) :2086-2090
[19]   MOLECULAR SCF CALCULATIONS FOR SCH3NH3 AND TIH3F [J].
STEVENSON, PE ;
LIPSCOMB, WN .
JOURNAL OF CHEMICAL PHYSICS, 1969, 50 (08) :3306-+
[20]   POTENTIAL FUNCTION FOR INVERSION OF AMMONIA [J].
SWALEN, JD ;
IBERS, JA .
JOURNAL OF CHEMICAL PHYSICS, 1962, 36 (07) :1914-&