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Mechanochemical Processes in Energetic Materials [E-Book] : A Computational and Experimental Investigation /
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Novel Coronavirus 2019 [E-Book] : In-silico Vaccine Design and Drug Discovery  /
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Chemical Physics of Molecular Condensed Matter [E-Book] /
24
Theoretical Chemistry for Experimental Chemists [E-Book] : Pragmatics and Fundamentals /
Table of Contents: ...1. Introduction -- 2. Actual Potentials of Theoretical Chemistry: What Can Be Obtained -- 2-1 Molecular Structure -- 2-2 Chemical Bonds -- 2-3 Electronic Structures -- 2-4 Electronic Properties -- 2-5 Optical Properties -- 2-6 Mechanical Properties -- 2...

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Noncovalent interactions in catalysis [E-Book] /
Subject (ZB): ...Valence (Theoretical chemistry)...

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Spectroscopy and dynamics of single molecules : methods and applications /
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...Developments in physical & theoretical chemistry...
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27
Chemical reactions : basic theory and computing /
Book
...Theoretical chemistry and computational modelling...
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Concepts, Methods and Applications of Quantum Systems in Chemistry and Physics [E-Book] : Selected proceedings of QSCP-XXI (Vancouver, BC, Canada, July 2016) /
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Photochemistry [E-Book] : A Modern Theoretical Perspective /
...Theoretical Chemistry and Computational Modelling...

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Structural Chemistry [E-Book] : Principles, Methods, and Case Studies /
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Chemical Reactions [E-Book] : Basic Theory and Computing /
...Theoretical Chemistry and Computational Modelling...

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Theoretical chemistry for electronic excited states [E-Book] /
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Physical chemistry of gas-liquid interfaces /
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...Developments in physical & theoretical chemistry...
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Applied theoretical organic chemistry /
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Subject (ZB): ...theoretical chemistry...
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Theoretical and computational chemistry series : physicochemical design based on nonlinear dynamics. Volume 14, Self-organized Motion [E-Book] /
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Principles and practices of molecular properties : theory, modeling and simulations /
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Subject (ZB): ...theoretical chemistry...
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37
Fundamentals of computational chemistry /
Book
Subject (ZB): ...theoretical chemistry...
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38
Multivalency : concepts, research & applications [E-Book] /
Subject (ZB): ...Valence (Theoretical chemistry)...

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Many-body Approaches at Different Scales [E-Book] : A Tribute to Norman H. March on the Occasion of his 90th Birthday /
Table of Contents: ... for fusion plasma engineering -- 15 Solar cell efficiency: the Shockley-Queisser limit revisited -- Part II Theoretical chemistry -- 16 Shannon entropy and correlation energy for electrons in atoms -- 17 On combinatoric identities for electron-pair wavefunctions...

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Theory and applications of the empirical valence bond approach  : from physical chemistry to chemical biology [E-Book] /