Semi-empirical Self-consistent-field Molecular Orbital Calculations on the Electronic Structure and Absorption Spectra of 1,4-, 1,6-, and 1,2-dihydronicotinamides PDF Download
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Author: Gerald Maurice Maggiora
Publisher:
ISBN:
Category :
Languages : en
Pages : 316
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Book Description
Author: Gerald Maurice Maggiora
Publisher:
ISBN:
Category :
Languages : en
Pages : 316
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Book Description
Author:
Publisher:
ISBN:
Category : Dissertations, Academic
Languages : en
Pages : 1128
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Author: J.R. Van Wazer
Publisher: Elsevier
ISBN: 032316112X
Category : Science
Languages : en
Pages : 117
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Book Description
Electron Densities in Molecules and Molecular Orbitals aims to explain the subject of molecular orbitals without having to rely much on its mathematical aspect, making it more approachable to those who are new to quantum chemistry. The book covers topics such as orbitals in quantum-chemical calculations; electronic ionizations and transitions; molecular-orbital change distributions; orbital transformations and calculations not involving orbitals; and electron densities and shapes in atoms and molecules. Also included in the book are the cross-sectional plots of electron densities of compounds such as organic compounds like methane, ethane, and ethylene; monomeric lithium fluoride and monomeric methyl lithium; hydrogen cyanide and methinophosphide; and monomeric borane and diborane. The text is recommended for those who have begun taking an interest in quantum chemistry but do not wish to deal yet with the mathematics part of the subject.
Author: Cheng Chen
Publisher:
ISBN:
Category :
Languages : en
Pages : 244
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Author: William Graham Richards
Publisher: Oxford University Press, USA
ISBN:
Category : Science
Languages : en
Pages : 116
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Book Description
Author: John D. Roberts
Publisher:
ISBN:
Category : Molecular orbitals
Languages : en
Pages : 176
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Author: Michael Scott Lee
Publisher:
ISBN:
Category :
Languages : en
Pages : 482
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Book Description
Author: K. Schofield
Publisher: Springer
ISBN: 1489958924
Category : Science
Languages : en
Pages : 439
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Book Description
Author: James E. Mark
Publisher: Oxford University Press, USA
ISBN: 9780195181012
Category : Reference
Languages : en
Pages : 1250
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Book Description
This new edition includes better values of properties already reported, properties not reported in time for the earlier edition, and entirely new properties becoming important for modern polymer applications. It also contains 217 total polymers, 20 of which are all-new, particularly in high-technology areas such as eletrical conductivity, non-linear optical properties, microlithography, nanophotonics, and electroluminescences. Examples of specific polymers include silsesquoxane ladder polymers, 'foldamer' self-assembling polymers, and block copolymers that phase separate into 'mushrooms', ellipsoids, and sheets with on surface radically different in properties from the other.
Author: Oren M. Becker
Publisher: CRC Press
ISBN: 9780203903827
Category : Medical
Languages : en
Pages : 534
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Book Description
Covering theoretical methods and computational techniques in biomolecular research, this book focuses on approaches for the treatment of macromolecules, including proteins, nucleic acids, and bilayer membranes. It uses concepts in free energy calculations, conformational analysis, reaction rates, and transition pathways to calculate and interpret b
