Quantum-chemical calculations of molecular systems as the basis of nanotechnologies in applied quantum chemistry [[electronic resource] ] . Volume 3 Quantum chemical calculation of monomers of cationic polymerization and other unique molecular systems / / V.A. Babkin and G.E. Zaikov, editors

• Record Nr.: UNINA9910453242003321
• Pubbl/distr/stampa: New York, : Nova Science Publishers, c2012
• ISBN: 1-62417-398-5
• Descrizione fisica: 1 online resource (247 p.)
• Collana: Nanotechnology science and technology; Chemistry research and applications
• Altri autori (Persone): BabkinV. A (Vasiliĭ Anatolʹevich); ZaikovG. E <1935-> (Gennadiĭ Efremovich)
• Disciplina: 620/.5
• Soggetti: Nanotechnology; Quantum chemistry - Data processing; Molecular structure - Data processing; Electronic books.
• Lingua di pubblicazione: Inglese
• Formato: Materiale a stampa
• Livello bibliografico: Monografia
• Note generali: Description based upon print version of record.
• Nota di bibliografia: Includes bibliographical references and index.
• Nota di contenuto: pt. I. Quantum-chemical calculation of chemical compounds, synthesized by laureates of Nobel Prize -- pt. II. Quantum-chemical calculation of cellulose -- pt. III. Quantum-chemical calculation of medical products -- pt. IV. Quantum-chemical calculation of jet engine fuels -- pt. V. Quantum-chemical calculation in biochemistry -- pt. VI. Quantum-chemical calculation of linear olefins of cationic polymerization by method ab initio -- pt. VII. Quantum-chemical calculation of linear olefins by method MNDO -- pt. VIII. Quantum-chemical calculation of linear olefins of cationic polymerization, branched out in A-position in relation to double bond by method ab initio -- pt. IX. Quantum-chemical calculation of linear monomers, branched out in A-position in relation to double bond by method MNDO -- pt. X. Quantum-chemical calculation of linear monomers, branched out in G-, D-, E-position in relation to double bond by ab initio -- pt. XI. Quantum-chemical calculation of isoolefins by method ; ab initio -- pt. XII. Quantum-chemical calculation of isoolefins by method MNDO -- pt. XIII. Quantum-chemical calculation of dienes and trienes by method ab initio -- pt. XIV. Quantum-chemical calculation of dienes and trienes by method MNDO -- pt. XV. Styrene and its derivations -- pt. XVI. Indene and its EGO derivations -- pt. XVII. Bicyclic olefins -- pt. XVIII. Compound with small cycles.