Computational chemistry : reviews of current trends. Vol. 3 /

A presentation of developments in the methodologies and applications of computational chemistry methods. The topics covered include fundamentals and applications of multireference Brillouin-Wigner coupled-cluster theory, and quantum-chemical modelling ofthe interaction of solute and solvent.

Detalles Bibliográficos
Clasificación:Libro Electrónico
Otros Autores: Leszczynski, Jerzy, 1949-
Formato: Electrónico eBook
Idioma:Inglés
Publicado: Singapore : World Scientific, ©1999.
Temas:
Chemistry > Data processing.
Chemistry > Computer simulation.
Chemistry > Mathematics.
Cheminformatics.
Chimio-informatique.
Chimie > Simulation par ordinateur.
SCIENCE > Chemistry > Clinical.
Cheminformatics
Chemistry > Computer simulation
Chemistry > Data processing
Chemistry > Mathematics
Acceso en línea:Texto completo

MARC

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245 0 0 |a Computational chemistry :  |b reviews of current trends. Vol. 3 /  |c editor, Jerzy Leszczynski. 
260 |a Singapore :  |b World Scientific,  |c ©1999. 
300 |a 1 online resource (ix, 325 pages) :  |b illustrations 
336 |a text  |b txt  |2 rdacontent 
337 |a computer  |b c  |2 rdamedia 
338 |a online resource  |b cr  |2 rdacarrier 
504 |a Includes bibliographical references and index. 
520 |a A presentation of developments in the methodologies and applications of computational chemistry methods. The topics covered include fundamentals and applications of multireference Brillouin-Wigner coupled-cluster theory, and quantum-chemical modelling ofthe interaction of solute and solvent. 
588 0 |a Print version record. 
505 0 |a 1. Multireference Brillouin-Wigner coupled-cluster theory / Ivan Hubac, Jozef Masik, Pavel Mach, Jan Urban and Peter Babinec -- 2. Model core potentials: theory and applications / Mariusz Klobukowski, Sigeru Huzinaga and Yoshiko Sakai -- 3. Stratospheric bromine chemistry: insights from computational studies / Sujata Guha and Joseph S. Francisco -- 4. Bonding in gas-phase sulfur radicals / David C. Young and Michael L. McKee -- 5. Chemistry of the liquid state: current trends in quantum-chemical modeling / Leonid Gorb and Jerzy Leszczynski -- 6. Chemistry and the internet / Ken Flurchick, Margaret Hurley, Jan. K. Labanowski, Gerald H. Lushington and Theresa L. Windus. 
590 |a eBooks on EBSCOhost  |b EBSCO eBook Subscription Academic Collection - Worldwide 
650 0 |a Chemistry  |x Data processing. 
650 0 |a Chemistry  |x Computer simulation. 
650 0 |a Chemistry  |x Mathematics. 
650 0 |a Cheminformatics. 
650 6 |a Chimio-informatique. 
650 6 |a Chimie  |x Simulation par ordinateur. 
650 7 |a SCIENCE  |x Chemistry  |x Clinical.  |2 bisacsh 
650 7 |a Cheminformatics  |2 fast 
650 7 |a Chemistry  |x Computer simulation  |2 fast 
650 7 |a Chemistry  |x Data processing  |2 fast 
650 7 |a Chemistry  |x Mathematics  |2 fast 
700 1 |a Leszczynski, Jerzy,  |d 1949- 
776 0 8 |i Print version:  |t Computational chemistry.  |d Singapore : World Scientific, ©1999  |z 9810237529  |w (OCoLC)50926291 
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