H. Schaefer III (Eds.) Modern Theoretical Chemistry Plenum Press, New York, (1977)
Abstract
A series of reviews on the applications of methods
of electronic structure theory. Chapter titles are: \apriori
geometry predictions; barriers to rotation and inversion;
hydrogen bonding and donor-acceptor interactions; direct use
of the gradient for investigating molecular energy surfaces;
transition metal compounds; strained organic molecules;
carbonium ions --- structural and energetic investigations;
molecular anions; electron spectroscopy; molecular fine
structure.
%0 Book
%1 hschaefer77:esapps
%B Modern Theoretical Chemistry
%C New York
%D 1977
%E Schaefer III, Henry F.
%I Plenum Press
%K chemistry quantum review
%T Applications of Electronic Structure Theory
%V 4
%X A series of reviews on the applications of methods
of electronic structure theory. Chapter titles are: \apriori
geometry predictions; barriers to rotation and inversion;
hydrogen bonding and donor-acceptor interactions; direct use
of the gradient for investigating molecular energy surfaces;
transition metal compounds; strained organic molecules;
carbonium ions --- structural and energetic investigations;
molecular anions; electron spectroscopy; molecular fine
structure.
%Z Series editors: W. H. Miller, H. F. Schaefer III, B. J. Berne and G. A. Segal.
@book{hschaefer77:esapps,
abstract = {A series of reviews on the applications of \abinitio methods
of electronic structure theory. Chapter titles are: \apriori
geometry predictions; barriers to rotation and inversion;
hydrogen bonding and donor-acceptor interactions; direct use
of the gradient for investigating molecular energy surfaces;
transition metal compounds; strained organic molecules;
carbonium ions --- structural and energetic investigations;
molecular anions; electron spectroscopy; molecular fine
structure.},
added-at = {2013-03-23T16:02:17.000+0100},
address = {New York},
annote = {Series editors: W. H. Miller, H. F. Schaefer III, B. J. Berne and G. A. Segal.},
biburl = {https://www.bibsonomy.org/bibtex/27ae84c5fe7074f1d3e3f3ed8da094ada/drmatusek},
editor = {Schaefer III, Henry F.},
interhash = {1ae7875639c9f2dec26b44246e66eae0},
intrahash = {7ae84c5fe7074f1d3e3f3ed8da094ada},
keywords = {chemistry quantum review},
publisher = {Plenum Press},
series = {Modern Theoretical Chemistry},
timestamp = {2013-03-23T16:02:18.000+0100},
title = {Applications of Electronic Structure Theory},
volume = 4,
year = 1977
}