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- [21] AB-INITIO MOLECULAR-ORBITAL CALCULATIONS OF BOND INDEX AND VALENCYADVANCES IN QUANTUM CHEMISTRY, 1992, 23 : 301 - 351SANNIGRAHI, AB
- [22] AB-INITIO MOLECULAR-ORBITAL STUDY OF THE REARRANGEMENT OF FLUOROALLENE TO SINGLET FLUOROVINYLMETHYLENEJOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1994, 118 (01): : 23 - 33HONJOU, NPACANSKY, JYOSHIMINE, M
- [23] AB-INITIO MOLECULAR-ORBITAL STUDY OF SUBSTITUTED CARBONYL-COMPOUNDSTHEORETICA CHIMICA ACTA, 1975, 36 (03): : 195 - 206DELBENE, JEWORTH, GTMARCHESE, FTCONRAD, ME
- [24] AN AB-INITIO MOLECULAR-ORBITAL STUDY OF THE UNIMOLECULAR DISSOCIATION REACTIONS OF VINYLCHLORIDEJOURNAL OF CHEMICAL PHYSICS, 1994, 100 (12): : 8976 - 8990RIEHL, JFMOROKUMA, K
- [25] AN AB-INITIO MOLECULAR-ORBITAL STUDY OF THE INSERTIONS OF DIFLUOROCARBENE INTO SUBSTITUTED ETHENESCROATICA CHEMICA ACTA, 1994, 67 (02) : 189 - 195WONG, CKLI, WK
- [26] HEATS OF FORMATION OF SIHMCLN CALCULATED BY AB-INITIO MOLECULAR-ORBITAL METHODSJOURNAL OF PHYSICAL CHEMISTRY, 1993, 97 (34): : 8732 - 8735SU, MDSCHLEGEL, HB
- [27] SIMULATED AB-INITIO MOLECULAR-ORBITAL TECHNIQUE .4. CYCLOHEXANESJOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (06) : 1319 - 1326EILERS, JEOLEARY, BDUKE, BJLIBERLES, AWHITMAN, DR
- [28] MULTICENTER BONDING IN CARBORANES - AB-INITIO AND SEMIEMPIRICAL MOLECULAR-ORBITAL STUDYMOLECULAR PHYSICS, 1973, 26 (02) : 435 - 452GUEST, MFHILLIER, IH
- [29] AB-INITIO MOLECULAR-ORBITAL STUDY OF CLF, HF BINARY COMPLEXESJOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1993, 104 (03): : 277 - 279DEALMEIDA, WBBARKER, DAHINCHLIFFE, ACRAW, JS
- [30] PREDICTION OF PLANARITY AND REDUCTION POTENTIAL OF DERIVATIVES OF TETRACYANOQUINODIMETHANE USING AB-INITIO MOLECULAR-ORBITAL THEORYJOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2, 1995, (05): : 907 - 909KENNY, PW