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Results: 1-12 |
Results: 12
AB-INITIO STUDY OF MOLECULAR-STRUCTURE AND INTERNAL-ROTATION IN METHYLDICYANOPHOSPHINE AND METHYLDIISOCYANOPHOSPHINE - THE RAMAN-SPECTRUM OF METHYLDICYANOPHOSPHINE AND ITS INTERPRETATION WITH THE USE OF SCALING OF AB-INITIO FORCE-FIELDS
Authors: KHAIKIN LS GRIKINA OE ZHILINSKII BI ZHILINSKAYA EA BASKIR EG NEPOMNYASHCHII RV FOMICHEVA OA PROSKURNINA MV
Citation: Ls. Khaikin et al., AB-INITIO STUDY OF MOLECULAR-STRUCTURE AND INTERNAL-ROTATION IN METHYLDICYANOPHOSPHINE AND METHYLDIISOCYANOPHOSPHINE - THE RAMAN-SPECTRUM OF METHYLDICYANOPHOSPHINE AND ITS INTERPRETATION WITH THE USE OF SCALING OF AB-INITIO FORCE-FIELDS, Russian chemical bulletin, 47(9), 1998, pp. 1653-1665
EFFICIENCY OF POST-HARTREE-FOCK FORCE-FIELD FOR THE INTERPRETATION OFVIBRATIONAL-SPECTRA OF N,N-DIMETHYLNITRAMINE
Authors: KHAIKIN LS GRIKINA OE PEREVOZCHIKOV VI KRAMARENKO SS SHLYAPOCHNIKOV VA BOGGS JE
Citation: Ls. Khaikin et al., EFFICIENCY OF POST-HARTREE-FOCK FORCE-FIELD FOR THE INTERPRETATION OFVIBRATIONAL-SPECTRA OF N,N-DIMETHYLNITRAMINE, Russian chemical bulletin, 47(8), 1998, pp. 1514-1525
STRUCTURAL RELAXATIONS AND ENERGY EFFECTS OF INTRAMOLECULAR MOTIONS IN N,N-DIMETHYLNITRAMINE - A THEORETICAL-STUDY
Authors: KHAIKIN LS GRIKINA OE PEREVOZCHIKOV VI ABRAMENKOV AV SHLYAPOCHNIKOV VA CORDELL FR BOGGS JE
Citation: Ls. Khaikin et al., STRUCTURAL RELAXATIONS AND ENERGY EFFECTS OF INTRAMOLECULAR MOTIONS IN N,N-DIMETHYLNITRAMINE - A THEORETICAL-STUDY, Russian chemical bulletin, 47(2), 1998, pp. 213-224
AB-INITIO CALCULATIONS OF THE STRUCTURE AND INVERSION BARRIERS OF CHLORAMIDE, H2NCL, AND N-CHLORO-N-METHYLMETHANAMINE, (CH3)(2)NCL
Authors: KHAIKIN LS GRIKINA OE PALAFOX MA VILKOV LV
Citation: Ls. Khaikin et al., AB-INITIO CALCULATIONS OF THE STRUCTURE AND INVERSION BARRIERS OF CHLORAMIDE, H2NCL, AND N-CHLORO-N-METHYLMETHANAMINE, (CH3)(2)NCL, Journal of molecular structure. Theochem, 417(3), 1997, pp. 215-221
INTERPRETATION OF THE VIBRATIONAL-SPECTRA OF CHLORAMIDE, H2NCL, ON THE BASIS OF POST-HARTREE-FOCK FORCE-FIELD
Authors: KHAIKIN LS GRIKINA OE PALAFOX MA
Citation: Ls. Khaikin et al., INTERPRETATION OF THE VIBRATIONAL-SPECTRA OF CHLORAMIDE, H2NCL, ON THE BASIS OF POST-HARTREE-FOCK FORCE-FIELD, Journal of molecular structure. Theochem, 417(1-2), 1997, pp. 187-193
AB-INITIO INVESTIGATION OF TAUTOMERIC STABILITY, MOLECULAR-STRUCTURE,AND INTERNAL-ROTATION OF METHYLPHOSPHONIC DICYANIDE, METHOXYDICYANOPHOSPHINE, AND THEIR ISOCYANO ANALOGS
Authors: KHAIKIN LS ZHILINSKAYA EA GRIKINA OE VILKOV LV
Citation: Ls. Khaikin et al., AB-INITIO INVESTIGATION OF TAUTOMERIC STABILITY, MOLECULAR-STRUCTURE,AND INTERNAL-ROTATION OF METHYLPHOSPHONIC DICYANIDE, METHOXYDICYANOPHOSPHINE, AND THEIR ISOCYANO ANALOGS, Russian chemical bulletin, 45(5), 1996, pp. 1043-1055
AB-INITIO CALCULATIONS OF THE STRUCTURE AND HARMONIC FORCE-FIELDS FORTHE AMINE FORMS OF DINITRAMINE AND METHYLDINITRAMINE - VIBRATIONAL-SPECTRA AND THEIR INTERPRETATION USING A SCALING PROCEDURE
Authors: KHAIKIN LS GRIKINA OE SHLYAPOCHNIKOV VA VILKOV LV BOCK CW
Citation: Ls. Khaikin et al., AB-INITIO CALCULATIONS OF THE STRUCTURE AND HARMONIC FORCE-FIELDS FORTHE AMINE FORMS OF DINITRAMINE AND METHYLDINITRAMINE - VIBRATIONAL-SPECTRA AND THEIR INTERPRETATION USING A SCALING PROCEDURE, Russian chemical bulletin, 44(11), 1995, pp. 2039-2052
TAUTOMERIC AND CONFORMATIONAL STABILITIES OF METHYLPHOSPHONIC DICYANIDE, METHOXYDICYANOPHOSPHINE, AND THEIR ISOCYANO ANALOGS - AN AB-INITIOCALCULATION
Authors: KHAIKIN LS ZHILINSKAYA EA GRIKINA OE PROSKURNINA MV VILKOV LV
Citation: Ls. Khaikin et al., TAUTOMERIC AND CONFORMATIONAL STABILITIES OF METHYLPHOSPHONIC DICYANIDE, METHOXYDICYANOPHOSPHINE, AND THEIR ISOCYANO ANALOGS - AN AB-INITIOCALCULATION, Journal of molecular structure, 356(3), 1995, pp. 239-246
INTERPRETATION OF THE VIBRATIONAL-SPECTRA OF NITRAMINES ON THE BASIS OF AB-INITIO CALCULATIONS
Authors: KHAIKIN LS GRIKINA OE SHLYAPOCHNIKOV VA BOGGS JE
Citation: Ls. Khaikin et al., INTERPRETATION OF THE VIBRATIONAL-SPECTRA OF NITRAMINES ON THE BASIS OF AB-INITIO CALCULATIONS, Russian chemical bulletin, 43(12), 1994, pp. 1987-1998
THE STRUCTURE OF NITROBENZENE AND THE INTERPRETATION OF THE VIBRATIONAL FREQUENCIES OF THE C-NO2 MOIETY ON THE BASIS OF AB-INITIO CALCULATIONS
Authors: SHLYAPOCHNIKOV VA KHAIKIN LS GRIKINA OE BOCK CW VILKOV LV
Citation: Va. Shlyapochnikov et al., THE STRUCTURE OF NITROBENZENE AND THE INTERPRETATION OF THE VIBRATIONAL FREQUENCIES OF THE C-NO2 MOIETY ON THE BASIS OF AB-INITIO CALCULATIONS, Journal of molecular structure, 326, 1994, pp. 1-16
NONEMPIRICAL QUANTUM-CHEMICAL CALCULATION FOR NITRAMIDE, ITS CHLOROSUBSTITUTED AND METHYL-SUBSTITUTED DERIVATIVES .1. STRUCTURE OF EQUILIBRIUM FORMS
Authors: KHAIKIN LS GRIKINA OE VILKOV LV PALAFOX MA BOGGS JE
Citation: Ls. Khaikin et al., NONEMPIRICAL QUANTUM-CHEMICAL CALCULATION FOR NITRAMIDE, ITS CHLOROSUBSTITUTED AND METHYL-SUBSTITUTED DERIVATIVES .1. STRUCTURE OF EQUILIBRIUM FORMS, Journal of structural chemistry, 34(1), 1993, pp. 2-8
NONEMPIRICAL QUANTUM-CHEMICAL CALCULATION FOR NITRAMIDE, ITS CHLOROSUBSTITUTED AND METHYL-SUBSTITUTED DERIVATIVES .2. STRUCTURES AND ENERGIES OF TRANSITION-STATES FOR INTERNAL-ROTATION AND INVERSION OF THE AMINO GROUP
Authors: KHAIKIN LS GRIKINA OE VILKOV LV BOGGS JE
Citation: Ls. Khaikin et al., NONEMPIRICAL QUANTUM-CHEMICAL CALCULATION FOR NITRAMIDE, ITS CHLOROSUBSTITUTED AND METHYL-SUBSTITUTED DERIVATIVES .2. STRUCTURES AND ENERGIES OF TRANSITION-STATES FOR INTERNAL-ROTATION AND INVERSION OF THE AMINO GROUP, Journal of structural chemistry, 34(1), 1993, pp. 9-16
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