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181
Theoretical Treatment of Large Molecules and Their Interactions : Part 4 Theoretical Models of Chemical Bonding
Published 1991
Springer Berlin Heidelberg
“
... themselves. However, modern computational
quantum
chemistry
has reached a state of maturity that one can...
”
Read Now
182
Frustrated Lewis Pairs I : Uncovering and Understanding
Published 2013
Springer Berlin Heidelberg
Table of Contents:
“
..., Imre Pápai --
Quantum
Chemistry
of FLPs and Their Activation of Small Molecules: Methodological Aspects...
”
Read Now
183
Computational Methods in Chemistry
by
Bargon, Joachim
Published 1980
Springer US
Table of Contents:
“
... of Ab Initio
Quantum
Chemistry
to Problems of Current Interest Raised by Experimentalists -- Computer...
”
Read Now
184
Hybrid Methods of Molecular Modeling
by
Tchougréeff, Andrei L.
Published 2008
Springer Netherlands
Table of Contents:
“
... of quantum mechanical technique -- Alternative representations -- Basics of
quantum
chemistry
-- Alternative...
”
Read Now
185
The Quantum Gamble
by
Boeyens, Jan C. A.
Published 2016
Springer International Publishing
“
... with open questions and remaining problems in terms of the plausibility of
quantum
chemistry
and physics...
”
Read Now
186
Radiation Induced Molecular Phenomena in Nucleic Acids : A Comprehensive Theoretical and Experimental Analysis
Published 2008
Springer Netherlands
Table of Contents:
“
...-Acceptor Molecules -- Photostability and Photoreactivity in Biomolecules:
Quantum
Chemistry
of Nucleic Acid...
”
Read Now
187
Scientific Computing on Supercomputers II
Published 1990
Springer US
Table of Contents:
“
... of Transputers in
Quantum
Chemistry
--
Quantum
chemistry
and computer -- Parallel computer architectures or why...
”
Read Now
188
Computational chemistry using the PC
by
Rogers, Donald W.
Published 2003
John Wiley & Sons
“
... revised and expanded coverage of molecular mechanics, molecular orbital theory, molecular
quantum
...
”
Call Number:
QD39.3.E46
Read Now
189
Chemical thermodynamics for industry
Published 2004
Royal Society of Chemistry
“
... liquids, new materials, ab-initia
quantum
chemistry
, nano-particles, polymer recycling, clathrates...
”
Read Now
190
Foundations of molecular quantum electrodynamics
by
Woolley, R. G.
Published 2022
Cambridge University Press
“
...,
quantum
chemistry
, and theoretical chemistry...
”
Call Number:
QC680
Read Now
191
Linear-Scaling Techniques in Computational Chemistry and Physics : Methods and Applications
Published 2011
Springer Netherlands
Table of Contents:
“
...-and-conquer approaches to
quantum
chemistry
: Theory and implementation -- Mathematical formulation...
”
Read Now
192
Transition Metal and Rare Earth Compounds III : Excited States, Transitions, Interactions
Published 2004
Springer Berlin Heidelberg
Table of Contents:
“
.... Daniel: Electronic Spectroscopy and Photoreactivity of Transition Metal Complexes:
Quantum
Chemistry
...
”
Read Now
193
Quantum Theory of Chemical Reactivity
by
Daudel, R.
Published 1973
Springer Netherlands
“
... the third of three volumes of a treatise on
quantum
chemistry
, the science resulting from the implementation...
”
Read Now
194
Molecular Dynamics Simulation
Published 2014
MDPI - Multidisciplinary Digital Publishing Institute
“
...-dealing with electron correlations is still a challenge for the methods of
quantum
chemistry
. Similarly...
”
Read Now
195
An introduction to the theory of graph spectra
by
Cvetković, Dragoš M.
,
Rowlinson, Peter
,
Simić, S.
Published 2010
Cambridge University Press
“
... wide range of subjects, including computer science,
quantum
chemistry
and electrical engineering...
”
Call Number:
QA166
Read Now
196
Homogenization in Time of Singularly Perturbed Mechanical Systems
by
Bornemann, Folkmar
Published 1998
Springer Berlin Heidelberg
“
... mechanics. The results are applied to special problems from plasma physics, molecular dynamics and
quantum
...
”
Read Now
197
Noncovalent Forces
Published 2015
Springer International Publishing
“
...Computational methods, and in particular
quantum
chemistry
, have taken the lead in our growing...
”
Read Now
198
Topological Approaches to the Chemical Bond
by
Martín Pendás, Ángel
,
Contreras-García, Julia
Published 2023
Springer International Publishing
“
..., exercises and solutions and is a great tool for any
quantum
chemistry
or computational chemistry course...
”
Read Now
199
Supercomputer Simulations in Chemistry : Proceedings of the Symposium on Supercomputer Simulations in Chemistry, held in Montreal August 25–27, 1985, sponsored by IBM-Kingston and...
Published 1986
Springer Berlin Heidelberg
Table of Contents:
“
...1. Some Aspects on the History of Computational
Quantum
Chemistry
: In view of the Development...
”
Read Now
200
Computational Science — ICCS 2003 : International Conference, Melbourne, Australia and St. Petersburg, Russia, June 2–4, 2003, Proceedings, Part IV
Published 2003
Springer Berlin Heidelberg
Table of Contents:
“
...Tonto: A Fortran Based Object-Oriented System for
Quantum
Chemistry
and Crystallography...
”
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