THEORY OF VIBRONIC INTERACTIONS - IMPORTANCE OF FLOATING BASIS SETS

被引：32

作者：

JOHNSON, WC

WEIGANG, OE

机构：

[1] OREGON STATE UNIV,DEPT BIOCHEM & BIOPHYS,CORVALLIS,OR 97331

[2] TULANE UNIV,DEPT CHEM,NEW ORLEANS,LA 70118

来源：

JOURNAL OF CHEMICAL PHYSICS | 1975年 / 63卷 / 05期

关键词：

D O I：

10.1063/1.431592

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

页码：2135 / 2143

页数：9

共 18 条

[1]

Born M, 1927, ANN PHYS-BERLIN, V84, P0457

[2] THE ROLE OF EG+ VIBRATIONS IN THE 2600-A - BENZENE BAND SYSTEM [J].

CRAIG, DP .

JOURNAL OF THE CHEMICAL SOCIETY, 1950, (JAN) :59-62

[3]

EYRING H, 1944, QUANTUM CHEMISTRY, P351

[4]

Herzberg G, 1933, Z PHYS CHEM B-CHEM E, V21, P410

[5] CALCULATION OF DELOCALIZATION CONTRIBUTION TO INFRARED INTENSITY [J].

JONES, WD ;

SIMPSON, WT .

JOURNAL OF CHEMICAL PHYSICS, 1960, 32 (06) :1747-1756

[6] ERRATA AND SOME ADDITIONAL COMMENTS ON CRITICAL STUDY OF VIBRONIC INTERACTION CALCULATIONS [J].

LIEHR, AD .

CANADIAN JOURNAL OF PHYSICS, 1958, 36 (11) :1588-1589

[7] CRITICAL STUDY OF VIBRONIC INTERACTION CALCULATIONS [J].

LIEHR, AD .

CANADIAN JOURNAL OF PHYSICS, 1957, 35 (09) :1123-1132

[8]

LIEHR AD, 1958, Z NATURFORSCH PT A, V13, P311

[9] CALCULATION OF VIBRONIC MAGNETIC ROTATIONAL STRENGTHS IN FORMALDEHYDE [J].

LINDER, RE ;

BUNNENBERG, E ;

SEAMANS, L ;

MOSCOWITZ, A .

JOURNAL OF CHEMICAL PHYSICS, 1974, 60 (05) :1943-1951

[10] ATOMS IN MOLECULES AND CRYSTALS [J].

MOFFITT, W .

PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1951, 210 (1101) :245-268

← 1 2 →