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- [2] MOLECULAR ORBITAL CALCULATIONS ON TRANSITION ELEMENT COMPOUNDS .3. MCZDO STUDIES OF PERMANGANATE AND CHROMATE THEORETICA CHIMICA ACTA, 1970, 17 (05): : 362 - &
- [3] MOLECULAR ORBITAL CALCULATIONS ON TRANSITION ELEMENT COMPOUNDS .2. CNDO TYPE STUDIES OF PERMANGANATE AND CHROMATE THEORETICA CHIMICA ACTA, 1970, 17 (04): : 279 - &
- [4] MOLECULAR ORBITAL CALCULATIONS ON TRANSITION ELEMENT COMPOUNDS .4. EFFECT OF ELECTROSTATIC ENVIRONMENT OF CRYSTAL LATTICES THEORETICA CHIMICA ACTA, 1970, 19 (01): : 45 - &
- [5] MOLECULAR ORBITAL CALCULATIONS ON TRANSITION-METAL COMPLEXES .1. HEXAFLUOROMETALLATE(II) IONS JOURNAL OF THE CHEMICAL SOCIETY A -INORGANIC PHYSICAL THEORETICAL, 1970, (16): : 2668 - &
- [7] MOLECULAR-ORBITAL CALCULATIONS FOR SOME AROMATIC HYDROCARBONS .1. JOURNAL OF THE CHEMICAL SOCIETY, 1951, (SEP): : 2391 - 2394
- [8] MOLECULAR ORBITAL CALCULATIONS OF VIBRATIONAL FORCE CONSTANTS .1. ETHYLENE JOURNAL OF CHEMICAL PHYSICS, 1948, 16 (05): : 526 - 532
- [9] ABINITIO MOLECULAR-ORBITAL CALCULATIONS ON SULFUR-COMPOUNDS .1. CHOICE AND PERFORMANCE OF BASIS SET JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1983, 14 (3-4): : 385 - 392
- [10] A SYSTEMATIC CLASSIFICATION OF ATOMIC INTEGRALS IN ABINITIO MOLECULAR-ORBITAL CALCULATIONS .1. THE CORE VALENCE APPROXIMATION MOLECULAR-ORBITAL METHOD JOURNAL OF CHEMICAL PHYSICS, 1981, 74 (07): : 3971 - 3976