CNDO/2-FPP ATOM-IN-MOLECULE POLARIZABILITIES

被引：34

作者：

RHEE, CH

METZGER, RM

WIYGUL, FM

机构：

来源：

JOURNAL OF CHEMICAL PHYSICS | 1982年 / 77卷 / 02期

关键词：

D O I：

10.1063/1.443905

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：899 / 915

页数：17

共 114 条

[61] HIGHER POLARIZABILITIES OF LINEAR MOLECULES [J].

MCLEAN, AD ;

YOSHIMINE, M .

JOURNAL OF CHEMICAL PHYSICS, 1967, 46 (09) :3682-+

[62] COMPUTED GROUND-STATE PROPERTIES OF FH AND CLH [J].

MCLEAN, AD ;

YOSHIMIN.M .

JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (09) :3256-&

[63] THE COHESIVE ENERGY OF TETRATHIAFULVALENIUM 7,7,8,8-TETRACYANOQUINODIMETHANIDE (TTF TCNQ) AS A FUNCTION OF CHARGE-TRANSFER [J].

METZGER, RM .

JOURNAL OF CHEMICAL PHYSICS, 1981, 75 (06) :3087-3096

[64] INDO AND MINDO-3 ATOM-IN-MOLECULE POLARIZABILITIES [J].

METZGER, RM .

JOURNAL OF CHEMICAL PHYSICS, 1981, 74 (06) :3444-3457

[65] MINDO-3-FP ATOM-IN-MOLECULE POLARIZABILITIES OF TCNQ, TTF, TMPD, AND OF THEIR RADICAL IONS [J].

METZGER, RM .

JOURNAL OF CHEMICAL PHYSICS, 1981, 74 (06) :3458-3471

[66]

METZGER RM, 1981, CRYSTAL COHESION CON, V26, P80

[67] MOLECULAR DIPOLE POLARIZABILITIES BASED ON MINDO-1 AND MINDO-2 WAVEFUNCTIONS [J].

MEYER, H ;

SCHWEIG, A .

THEORETICA CHIMICA ACTA, 1973, 29 (04) :375-382

[68]

Miyazaki T., 1973, B CHEM SOC JPN, V46, P1216

[69] PERTURBED SCF MO CALCULATIONS . ELECTRICAL POLARIZABILITY AND MAGNETIC SUSCEPTIBILITY OF HF H2O NH3 AND CH4 [J].

MOCCIA, R .

THEORETICA CHIMICA ACTA, 1967, 8 (03) :192-&

[70] INTERMOLECULAR POTENTIALS FROM CRYSTAL DATA .3. DETERMINATION OF EMPIRICAL POTENTIALS AND APPLICATION TO PACKING CONFIGURATIONS AND LATTICE ENERGIES IN CRYSTALS OF HYDROCARBONS, CARBOXYLIC-ACIDS, AMINES, AND AMIDES [J].

MOMANY, FA ;

CARRUTHERS, LM ;

MCGUIRE, RF ;

SCHERAGA, HA .

JOURNAL OF PHYSICAL CHEMISTRY, 1974, 78 (16) :1595-1620

← 2 3 4 5 6 7 8 9 10 11 →