ABINITIO CALCULATION OF THE STRUCTURE AND INTER-MOLECULAR VIBRATIONAL FREQUENCIES OF THE H3CCN...HF COMPLEX

被引：7

作者：

CURTISS, LA

机构：

[1] Chemical Engineering Division, Argonne National Laboratory, Argonne

来源：

JOURNAL OF MOLECULAR STRUCTURE | 1979年 / 54卷 / JUL期

关键词：

D O I：

10.1016/0022-2860(79)80071-X

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：239 / 241

页数：3

共 9 条

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[2] Cross P. C, 1955, MOL VIBRATIONS
[3] MOLECULAR-ORBITAL CALCULATION OF SOME VIBRATIONAL PROPERTIES OF COMPLEX BETWEEN HCN AND HF
CURTISS, LA
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[4] THEORY OF MOLECULAR INTERACTIONS .1. MOLECULAR ORBITAL STUDIES OF WATER POLYMERS USING A MINIMAL SLATER-TYPE BASIS
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POPLE, JA
[J]. JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (09) : 4858 - +
[5] SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .9. EXTENDED GAUSSIAN-TYPE BASIS FOR MOLECULAR-ORBITAL STUDIES OF ORGANIC MOLECULES
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HEHRE, WJ
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[J]. JOURNAL OF CHEMICAL PHYSICS, 1971, 54 (02) : 724 - +
[6] MICROWAVE SPECTROSCOPIC INVESTIGATIONS OF HYDROGEN-BONDED COMPLEXES
MILLEN, DJ
[J]. JOURNAL OF MOLECULAR STRUCTURE, 1978, 45 (MAY) : 1 - 22
[7] MOLECULAR ORBITAL THEORY OF ELECTRONIC STRUCTURE OF ORGANIC COMPOUNDS .1. SUBSTITUENT EFFECTS AND DIPOLE MOMENTS
POPLE, JA
GORDON, M
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1967, 89 (17) : 4253 - &
[8] MOLECULAR ORBITAL THEORY OF ELECTRONIC STRUCTURE OF ORGANIC COMPOUNDS .8. GEOMETRIES, ENERGIES, AND POLARITIES OF C3 HYDROCARBONS
RADOM, L
LATHAN, WA
HEHRE, WJ
POPLE, JA
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1971, 93 (21) : 5339 - &
[9] HYDROGEN BONDING IN GAS PHASE - INFRARED SPECTRA OF COMPLEXES OF HYDROGEN FLUORIDE WITH HYDROGEN CYANIDE AND METHYL CYANIDE
THOMAS, RK
[J]. PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1971, 325 (1560): : 133 - &

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