Quantum-Chemical Calculations of Molecular Systems as the Basis of Nanotechnologies in Applied Quantum Chemistry de V. A. Babkin

Quantum-Chemical Calculations of Molecular Systems as the Basis of Nanotechnologies in Applied Quantum Chemistry

V. A. Babkin

G. E. Zaikov

This book is one of many volumes which presents current research in the study of quantum-chemical calculations of various molecular systems. The research results presented suggest that the development of nanotechnologies will offer new and more effective advancements for the improvement of penicillins, vitamins and catalysts. The results of quantum-chemical calculations of various molecular systems presented here are the first step toward the development of new nanotechnologies.

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Hardback (3)	1133^.04 lei 3-5 săpt.
Nova Science Publishers Inc – 29 feb 2012	1133^.04 lei 3-5 săpt.
Nova Science Publishers Inc – 29 feb 2012	1139^.34 lei 3-5 săpt.
Nova Science Publishers Inc – 29 feb 2012	1139^.81 lei 3-5 săpt.

Preț

Express

Hardback (3)

1133^.04 lei 3-5 săpt.

Nova Science Publishers Inc – 29 feb 2012

1133^.04 lei 3-5 săpt.

Nova Science Publishers Inc – 29 feb 2012

1139^.34 lei 3-5 săpt.

Nova Science Publishers Inc – 29 feb 2012

1139^.81 lei 3-5 săpt.

Cuprins

Preface; Geometrical & electronic structure of terpenes; Geometrical & electronic structure of the molecule of insecticide DDT (dichlorodiphenyltrichloroethane) or 2, 2-BIS-(4-chlorophenyl)1,1,1-trichloroethane); Geometrical & electronic structure of the molecule of formaldehyde; Research of geometrical & electronic structure of molecule nematic n-(para-methoxybenzylidene) para- butylaniline by method MNDO; Research of geometrical & electronic structure of molecule of smectic liquid crystal terephthalbis(para-butylaniline) by method MNDO; Research of geometrical & electronic structure of molecules of mono-, di-, trinitrocellulose by method MNDO; Research geometrical & electronic structure of different fuels by method AB INITIO; Research of geometrical & electronic structure of heterocyclic nitrogen bases «alphabet» of genetic code by method AB INITIO; Research of geometrical & electronic structure of molecules of monomer of cationic polymerization, branched out in α-position in relation to double bond by method MNDO; Quantum chemical calculation of molecules of monomer of cationic polymerization branched out in α-position in relation to double bond by method AB INITIO; Research of geometrical & electronic structure of molecule vinylcyclopentane by method MNDO; Research of geometrical & electronic structure of molecule methylenecyclopentane by method MNDO; Research of geometrical & electronic structure of molecule 1-methylcyclopentene by method MNDO; Research of geometrical & electronic structure molecule 3-methylcyclopentene by method MNDO; Research of geometrical & electronic structure of molecule cyclopentene method MNDO; Research of geometrical & electronic structure of molecule methylenecyclobutane method MNDO; Research of geometrical & electronic structure of molecule 1,1-dicyclopropylethylene by method MNDO; Research of geometrical & electronic structure molecule isopropylcyclopropane by method MNDO; Research of geometrical & electronic structure molecule vinylcyclopropane by method MNDO; Research of geometrical & electronic structure molecule methylenecyclopropane by method MNDO; Research of geometrical & electronic structure of molecule 5-methylallyl-1,3-cyclopentadiene by method MNDO; Research of geometrical & electronic structure of molecule 5-allyl-1,3-cyclopentadiene by method MNDO; Research of geometrical & electronic structure of molecule 1,2-dimethyl-1,3-cyclopentadiene by method MNDO; Research of geometrical & electronic structure of molecule 6-methyl-6-ethylfulvene by method AB INITIO; Research of geometrical & electronic structure of molecule 6,6-dimethylfulvene by method AB INITIO; Research of geometrical & electronic structure of molecule 1,2-dimethyl-1,3-cyclopenadiene by method AB INITIO; Research of geometrical & electronic structure of molecule 2,7-spirodecane by method MNDO; Research of geometrical & electronic structure of molecule 2,6-spironane by method MNDO; Research of geometrical & electronic structure of molecule 2,5-spirooctane by method MNDO; Research of geometrical & electronic structure of molecule 7,7-dichlorinebicyclo[4,1,0]heptane by method AB INITIO; Research of geometrical & electronic structure of molecule 1-methyl-1-vinyl-2,2-dichlorinecyclopropane by method AB INITIO; Research of geometrical & electronic structure of molecule 2-methyl-1,1-dichlorine-2-para-chlorophenylcyclopropane by method AB; Research of geometrical & electronic structure of molecule 2-methyl-2-phenyl-1,1-dichlorinecyclopropane by method AB INITIO; Research of geometrical & electronic structure of molecule 2,2,3-trimethyl-1,1-dichlorinecyclopropane by method AB INITIO 35; Research of geometrical & electronic structure of molecule 2,2-dimethyl-1,1-dichlorinecyclopropane by method AB INITIO; Research of geometrical & electronic structure of molecule 2,7-spirodecane by method AB INITIO; Research of geometrical & electronic structure of molecule 2-methyl-5-isopropylstyrene by method MNDO; Research of geometrical & electronic structure of molecule 2,4-dimethylstyrene by method MNDO; Research of geometrical & electronic structure of molecule о-isopropylstyrene by method MNDO; Research of geometrical & electronic structure molecule o-methylstyrene by method MNDO; Research of geometrical & electronic structure of molecule para-tert-butylstyrene by method MNDO; Research of geometrical & electronic structure of molecule para-isopropylstyrene by method MNDO; Research of geometrical & electronic structure of molecule para- ethylstyrene by method MNDO; Research of geometrical & electronic structure of molecule p-isopropylstyrene by method AB INITIO; Research of geometrical & electronic structure of molecule lstyrene by method AB INITIO; Research of geometrical & electronic structure of molecule 3,4-dichlorstyrene by method AB INITIO; Research of geometrical & electronic structure of molecule м-chlorstyrene by method AB INITIO; Research of geometrical & electronic structure of molecule о-chlorstyrene by method AB INITIO; Research of geometrical & electronic structure of molecule p- fluorostyrene by method AB INITIO; Research of geometrical & electronic structure of molecule 2,6-dimethyl-4-tret-butylstyrene by method AB INITIO; Research of geometrical & electronic structure of molecule vinylmesitylene by method AB INITIO; Research of geometrical & electronic structure of molecule 2,3-dimethylindene by method MNDO; Research of geometrical & electronic structure of molecule 1,1-dimethylindene by method MNDO; Research of geometrical & electronic structure of molecule 7-methylindene by method MNDO; Research of geometrical & electronic structure of molecule 6-methylindene by method MNDO; Research of geometrical & electronic structure of molecule 5-methylindene by method MNDO; Research of geometrical & electronic structure of molecule 3-methylindene by method MNDO; Research of geometrical & electronic structure of molecule 5,7-dimethylindene by method AB INITIO; Research of geometrical & electronic structure of molecule 5,6-dimethylindene by method AB INITIO; Research of geometrical & electronic structure of molecule 4,6-dimethylindene by method AB INITIO; Research of geometrical & electronic structure of molecule 1,1-dimethylindene by method AB INITIO.; Research of geometrical & electronic structure of molecule 2,7-diphenyloctadiene-1,7 by method MNDO; Research of geometrical & electronic structure of molecule 2,6-diphenylheptadiene-1,6 by method MNDO; Research of geometrical & electronic structure of molecule 2,5-diphenylhexadiene-1,5 by method MNDO; Research of geometrical & electronic structure of molecule о-divinylbenzene by method MNDO; Research of geometrical & electronic structure of molecule 1,2-dihydronaphthalene by method MNDO; Research of geometrical & electronic structure of molecule allylbenzol by method MNDO; Index.