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Chemistry - Theoretical and Computational Chemistry | Subchannel Theoretical and Computational Chemistry

Featured Journals

Journal of Mathematical Chemistry

The Journal of Mathematical Chemistry (JOMC) publishes original, chemically important mathematical results which use non-routine mathematical methodologies often unfamiliar to the usual audience of mainstream experimental and theoretical chemistry journals. ... More

Structural Chemistry

The journal Structural Chemistry offers peer-reviewed original research papers on condensed and gaseous states of matter. Coverage includes techniques for the determination of structure and energetics, their results & the conclusions derived from these studies ... More

Featured Books

9789400707108

Handbook of Computational Chemistry

This handbook provides an accessible introduction to the methods and concepts of computational and quantum chemistry. Coverage includes molecular mechanics, quantum mechanics, and statistical mechanics calculations

Self-Assembly of Flat Organic Molecules on Metal Surfaces

Manuela Mura's thesis is devoted to ab initio studies of self-assembled organic molecules on a gold surface. This area of research is particularly vibrant because of the various applications such studies have in nanoscience and surface chemistry and physics. ... More

Featured Book Series

Highlights in Theoretical Chemistry

Selected researchers in theoretical chemistry present research highlights, thoughtful reviews and forward-looking perspectives on major developments in the field, originally published in the journal Theoretical Chemistry Accounts ... More

Progress in Theoretical Chemistry and Physics

Progress in Theoretical Chemistry and Physics book series provides timely and in-depth coverage of selected topics and broad-ranging yet detailed analysis of contemporary theories and their applications. ... More


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Books in Theoretical and Computational Chemistry

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  • Computational Materials System Design
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    Computational Materials System Design

    Shin, Dongwon, Saal, James (Eds.) 2018

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    $84.99 (net)
    ISBN 978-3-319-68280-8
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    ISBN 978-3-319-68278-5
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  • Frontiers of Quantum Chemistry
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    Frontiers of Quantum Chemistry

    Wójcik, M.J., Nakatsuji, H., Kirtman, B., Ozaki, Y. (Eds.) 2018

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    ISBN 978-981-10-5651-2
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    ISBN 978-981-10-5650-5
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  • Acoustic Cavitation and Bubble Dynamics
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    Acoustic Cavitation and Bubble Dynamics

    Series: SpringerBriefs in Molecular Science

    Subseries: Ultrasound and Sonochemistry

    Yasui, Kyuichi 2018

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    ISBN 978-3-319-68237-2
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    ISBN 978-3-319-68236-5
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  • Influence of Particle Beam Irradiation on the Structure and Properties of Graphene
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    Influence of Particle Beam Irradiation on the Structure and Properties of Graphene

    Series: Springer Theses

    Wu, Xin 2018

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    ISBN 978-981-10-6457-9
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    ISBN 978-981-10-6456-2
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  • Advanced Computing in Industrial Mathematics
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    Advanced Computing in Industrial Mathematics

    11th Annual Meeting of the Bulgarian Section of SIAM December 20-22, 2016, Sofia, Bulgaria. Revised Selected Papers

    Series: Studies in Computational Intelligence, Vol. 728

    Georgiev, Krassimir, Todorov, Michail, Georgiev, Ivan (Eds.) 2018

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    ISBN 978-3-319-65530-7
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    ISBN 978-3-319-65529-1
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  • Multi-shell Polyhedral Clusters
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      $189.00
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    Multi-shell Polyhedral Clusters

    Series: Carbon Materials: Chemistry and Physics, Vol. 10

    Diudea, Mircea Vasile 2018

    Price from $149.00
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    ISBN 978-3-319-64123-2
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    ISBN 978-3-319-64121-8
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  • Liganded silver and gold quantum clusters. Towards a new class of nonlinear optical nanomaterials
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    Liganded silver and gold quantum clusters. Towards a new class of nonlinear optical nanomaterials

    Series: SpringerBriefs in Materials

    Antoine, Rodolphe, Bonačić-Koutecký, Vlasta 2018

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    ISBN 978-3-319-64743-2
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    ISBN 978-3-319-64742-5
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  • Quantum Computational Chemistry
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    Quantum Computational Chemistry

    Modelling and Calculation for Functional Materials

    Onishi, Taku 2018

    Price from $149.00
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    ISBN 978-981-10-5933-9
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    ISBN 978-981-10-5932-2
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  • Applications of Quantum Dynamics in Chemistry
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    Applications of Quantum Dynamics in Chemistry

    Series: Lecture Notes in Chemistry, Vol. 98

    Gatti, F., Lasorne, B., Meyer, H.-D., Nauts, A. 2017

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    ISBN 978-3-319-53923-2
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    $129.00 (net)
    ISBN 978-3-319-53921-8
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  • Energetic Materials
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      $349.00
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      $349.00
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    Energetic Materials

    From Cradle to Grave

    Series: Challenges and Advances in Computational Chemistry and Physics, Vol. 25

    Shukla, M., Boddu, V.M., Steevens, J.A., Damavarapu, R., Leszczynski, J. (Eds.) 2017

    Price from $269.00
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    ISBN 978-3-319-59208-4
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    ISBN 978-3-319-59206-0
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