INTRAMOLECULAR INTERACTION EFFECTS AND THE STRUCTURE OF N2OS AND N2O2 - AN ABINITIO STUDY

被引：12

作者：

BOCK, C

TRACHTMAN, M

SCHMIEDEKAMP, A

GEORGE, P

CHIN, TS

机构：

[1] PENNS STATE UNIV,DEPT PHYS,ABINGTON,PA 19001

[2] UNIV PENN,DEPT BIOL,PHILADELPHIA,PA 19104

来源：

JOURNAL OF COMPUTATIONAL CHEMISTRY | 1983年 / 4卷 / 03期

关键词：

D O I：

10.1002/jcc.540040313

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：379 / 389

页数：11

共 32 条

[1] INVESTIGATION OF 2050 A SYSTEM OF NITRIC OXIDE DIMER [J].

BILLINGSLEY, J ;

CALLEAR, AB .

TRANSACTIONS OF THE FARADAY SOCIETY, 1971, 67 (579) :589-+

[2] ABINITIO STUDY OF THE GEOMETRIES, ANHARMONIC-FORCE FIELDS AND FUNDAMENTAL VIBRATION FREQUENCIES OF CIS-FORMIC AND TRANS-FORMIC ACID [J].

BOCK, CW ;

TRACHTMAN, M ;

GEORGE, P .

JOURNAL OF MOLECULAR SPECTROSCOPY, 1980, 80 (01) :131-144

[3] AN ABINITIO STUDY OF THE GEOMETRY, HARMONIC AND ANHARMONIC-FORCE FIELDS, AND FUNDAMENTAL VIBRATIONAL FREQUENCIES OF CIS-THIOLFORMIC AND TRANS-THIOLFORMIC ACID [J].

BOCK, CW ;

TRACHTMAN, M ;

GEORGE, P .

JOURNAL OF COMPUTATIONAL CHEMISTRY, 1980, 1 (02) :167-177

[4] VIBRATIONAL SPECTRA AND STRUCTURE OF S4N4 AND S2N2 [J].

BRAGIN, J ;

EVANS, MV .

JOURNAL OF CHEMICAL PHYSICS, 1969, 51 (01) :268-&

[5] MICROWAVE SPECTRUM, STRUCTURE, LOW FREQUENCY VIBRATIONS, DIPOLE MOMENT AND QUADRUPOLE COUPLING CONSTANTS OF DINITROGEN TRIOXIDE [J].

BRITTAIN, AH ;

COX, AP .

TRANSACTIONS OF THE FARADAY SOCIETY, 1969, 65 (560P) :1963-&

[6] COMPLIANCE MATRIX AND MOLECULAR VIBRATIONS [J].

DECIUS, JC .

JOURNAL OF CHEMICAL PHYSICS, 1963, 38 (01) :241-&

[7] COMMENT ON STRUCTURE OF (NO)2 IN MOLECULAR CRYSTAL [J].

DINERMAN, CE ;

EWING, GE .

JOURNAL OF CHEMICAL PHYSICS, 1971, 54 (08) :3660-&

[8] INFRARED SPECTRUM, STRUCTURE, AND HEAT OF FORMATION OF GASEOUS (NO)2 [J].

DINERMAN, CE ;

EWING, GE .

JOURNAL OF CHEMICAL PHYSICS, 1970, 53 (02) :626-&

[9] SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .9. EXTENDED GAUSSIAN-TYPE BASIS FOR MOLECULAR-ORBITAL STUDIES OF ORGANIC MOLECULES [J].

DITCHFIELD, R ;

HEHRE, WJ ;

POPLE, JA .

JOURNAL OF CHEMICAL PHYSICS, 1971, 54 (02) :724-+

[10] GAUSSIAN BASIS FUNCTIONS FOR USE IN MOLECULAR CALCULATIONS .1. CONTRACTION OF (9S5P) ATOMIC BASIS SETS FOR FIRST-ROW ATOMS [J].

DUNNING, TH .

JOURNAL OF CHEMICAL PHYSICS, 1970, 53 (07) :2823-+

← 1 2 3 4 →