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21
Published 1985
Springer Berlin Heidelberg
Table of Contents: “... computer-abhängige Methode -- 8.1Einleitung -- 8.2 Das Prinzip der Röntgenbeugung -- 8.3 Ablauf einer...”
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22
Published 1981
Springer Netherlands
Table of Contents: “...Some Fundamentals of Computational Theoretical Chemistry -- Gaussian Basis Sets -- Single...”
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23
by Rogers, Donald W.
Published 2003
John Wiley & Sons
Subjects: “...Computational chemistry...”
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24
by Sharkey, Keeper L., Chancé, Alain
Published 2022
Packt Publishing, Limited
Table of Contents: “...Table of Contents Introduction Postulates of quantum mechanics Quantum circuit model of computation...”
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25
by Teixeira-Dias, José J. C.
Published 2017
Springer International Publishing
Subjects: “...Physical chemistry...”
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26
Published 2017
Springer International Publishing
Subjects: “...Theoretical and Computational Chemistry...”
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27
Published 2008
Springer Netherlands
Table of Contents: “... on Radiative and Non-Radiative Excited State Decays -- The Sequential qm/mm Method and its Applications...”
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28
by Fraga, Serafin, Parker, J.M.Robert, Pocock, Jennifer M.
Published 1995
Springer Berlin Heidelberg
Table of Contents: “... Mechanics: Computer Simulations -- Practical Overview -- Experimental and Theoretical Data -- Databases...”
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29
Published 2013
Springer International Publishing
Table of Contents: “... and Interfaces.-Molecular and Nano-Materials, Electronics and Biology.-Computational Chemistry, Physics...”
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30
Published 2022
Springer International Publishing
Table of Contents: “... -- Application of Computational Chemistry for Contaminant Adsorption on the Components of Soil Surfaces...”
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31
Published 2016
Springer US
Table of Contents: “...Relativistic Effects and Quantum Electrodynamics in Chemistry -- How Can One Locate the Global...”
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32
Published 2012
Springer Netherlands
Table of Contents: “... -- The distribution of internal distances for ionic pairs in solvents of various polarity -- Digraph in Chemistry: All...”
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33
Published 1991
Springer Netherlands
Table of Contents: “...Chemistry as an exact science -- Computational bottlenecks in molecular orbital calculations...”
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34
Published 2014
Springer US
Table of Contents: “... H. Bowen, and Janusz Rak -- Hints from Computational Chemistry: Mechanisms ofTransformations...”
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35
by Minkin, Vladimir I., Simkin, Boris Ya, Minyaev, Ruslan M.
Published 1990
Springer Berlin Heidelberg
Table of Contents: “... Reaction and Quantum Chemistry -- 1.2 Choice of a Coordinate System and the Representation of a PES -- 1.3...”
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36
by Lente, Gábor
Published 2015
Springer International Publishing
Subjects: “...Mathematical Applications in Chemistry...”
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37
by Zheng, Neng-Wu
Published 2023
Springer Nature Singapore
Table of Contents: “... Electron theory (I) -- The Weakest Bound Electron theory (II) -- The application of the WBE theory...”
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38
Published 2018
Springer International Publishing
Table of Contents: “...Quantum Chemistry Methodology -- Molecular Structure and Dynamics -- Biochemistry and Biophysics...”
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39
by White, Ralph E., Subramanian, Venkat R.
Published 2010
Springer Berlin Heidelberg
Subjects: “...Chemistry, Physical and theoretical...”
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40
by Bruns, W., Motoc, I., O'Driscoll, K. F.
Published 1981
Springer Berlin Heidelberg
Table of Contents: “...1 The Monte Carlo Method and Applications -- 2 Monte Carlo Calculation of Sequence Distributions...”