FREQUENCY OPTIMIZED POTENTIAL-ENERGY FUNCTIONS FOR THE GROUND-STATE SURFACES OF HCN AND HCP

被引：177

作者：

MURRELL, JN ^{[1
]}

CARTER, S ^{[1
]}

HALONEN, LO ^{[1
]}

机构：

[1] THEORET CHEM DEPT,OXFORD OX1 3TG,ENGLAND

来源：

JOURNAL OF MOLECULAR SPECTROSCOPY | 1982年 / 93卷 / 02期

关键词：

D O I：

10.1016/0022-2852(82)90170-9

中图分类号：

O64 [物理化学（理论化学）、化学物理学]; O56 [分子物理学、原子物理学];

学科分类号：

070203 ; 070304 ; 081704 ; 1406 ;

摘要：

引用

页码：307 / 316

页数：10

共 15 条

[1] ANALYTICAL FUNCTIONS FOR THE GROUND-STATE POTENTIAL SURFACES OF C3(X 1SIGMA-G+) AND HCN(X 1SIGMA+)
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[2] CARTER S, MOL PHYS
[3] ANHARMONIC-FORCE FIELD AND EQUILIBRIUM STRUCTURE OF HNC
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[4] HIGH-RESOLUTION INFRARED-ABSORPTION SPECTRUM OF H12CP - NU-3 BAND
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[J]. JOURNAL OF MOLECULAR SPECTROSCOPY, 1980, 79 (02) : 502 - 506
[5] V1 AND V1+V2-V2 INFRARED-ABSORPTION BANDS OF H12CP
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[J]. JOURNAL OF MOLECULAR SPECTROSCOPY, 1978, 69 (02) : 319 - 325
[6] THE VIBRATION-ROTATION SPECTRUM OF METHINOPHOSPHIDE - I-TYPE DOUBLING, I-TYPE RESONANCE AND THE NU-2, 2NU-2, AND 3NU-2 BANDS OF H12CP - THE NU-1 AND NU-2 BANDS OF H13CP
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[J]. JOURNAL OF MOLECULAR SPECTROSCOPY, 1981, 87 (02) : 490 - 505
[7] HIGH-TEMPERATURE, HIGH-RESOLUTION INFRARED SPECTRAL MEASUREMENTS ON THE HNC-HCN EQUILIBRIUM SYSTEM
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SAMS, RL
[J]. JOURNAL OF CHEMICAL PHYSICS, 1981, 75 (09) : 4178 - 4182
[8] MICROWAVE AND INFRARED MEASUREMENTS ON HCN AND DCN - OBSERVATIONS ON L-TYPE RESONANCE DOUBLETS
MAKI, AG
LIDE, DR
[J]. JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (09) : 3206 - &
[9] SPECTROSCOPIC STUDY OF VACUUM-ULTRAVIOLET PHOTOLYSIS OF MATRIX-ISOLATED HCN AND HALOGEN CYANIDES . INFRARED SPECTRA OF SPECIES CN AND XNC
MILLIGAN, DE
JACOX, ME
[J]. JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (01) : 278 - &
[10] Mills I. M., 1974, THEORETICAL CHEMISTR, V1, P110

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