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- [1] Towards an adequate molecular orbital interpretation of the ultraviolet spectrum of the permanganate ion[J]. CHEMICAL PHYSICS LETTERS, 1967, 1 (10) : 459 - 464Brown, R. D.James, B. H.O'Dwyer, M. F.Roby, K. R.
- [2] APPROXIMATE MOLECULAR ORBITAL THEORY FOR INORGANIC MOLECULES .2. METHODS OF EVALUATING BASIC PARAMETERS[J]. THEORETICA CHIMICA ACTA, 1970, 16 (03): : 194 - +BROWN, RDROBY, KR
- [3] MOLECULAR ORBITAL CALCULATIONS ON TRANSITION ELEMENT COMPOUNDS .1. METHOD[J]. THEORETICA CHIMICA ACTA, 1970, 17 (04): : 264 - +BROWN, RDJAMES, BHODWYER, MF
- [4] MOLECULAR ORBITAL CALCULATIONS ON TRANSITION METAL COMPLEXES .2. HEXA-AQUOMETAL(II) AND HEXA-AQUOMETAL(III) IONS[J]. JOURNAL OF THE CHEMICAL SOCIETY A -INORGANIC PHYSICAL THEORETICAL, 1971, (02): : 299 - &CLACK, DWFARRIMON.MS
- [5] MOLECULAR ORBITAL CALCULATIONS ON TRANSITION METAL COMPOUNDS[J]. COORDINATION CHEMISTRY REVIEWS, 1971, 6 (2-3) : 95 - &DAVIES, DRWEBB, GA
- [6] GROUND STATES OF CONJUGATED MOLECULES .9. HYDROCARBON RADICALS AND RADICAL IONS[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1968, 90 (08) : 1953 - &DEWAR, MJSHASHMALL, JAVENIER, CG
- [7] GENERALIZATION OF DEWARS HALF-ELECTRON METHOD FOR CALCULATING ENERGIES OF OPEN-SHELL ELECTRONIC STATES[J]. CHEMICAL PHYSICS LETTERS, 1971, 10 (03) : 322 - &ELLISON, FOMATHEU, FM
- [8] OPEN SHELL SCF MO CI CALCULATION OF SPIN DENSITY DISTRIBUTIONS[J]. THEORETICA CHIMICA ACTA, 1966, 5 (03): : 208 - +HINCHLIFFE, A
- [9] THE ELECTRONIC SPECTRA OF AROMATIC MOLECULES .2. A THEORETICAL TREATMENT OF EXCITED STATES OF ALTERNANT HYDROCARBON MOLECULES BASED ON SELF-CONSISTENT MOLECULAR ORBITALS[J]. PROCEEDINGS OF THE PHYSICAL SOCIETY OF LONDON SECTION A, 1955, 68 (02): : 81 - 89POPLE, JA
- [10] POPLE JA, 1971, APPROXIMATE MOLECULA