The Application of Quantum Mechanics in Reactivity of Molecules
Over recent decades, the increase in computational resources, coupled with the popularity of competitive quantum mechanics alternatives (particularly DFT), has promoted the widespread penetration of quantum mechanics calculations into a variety of fields targeting the reactivity of molecules. This b...
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Andere auteurs: | |
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Formaat: | Elektronisch Hoofdstuk |
Taal: | Engels |
Gepubliceerd in: |
Basel, Switzerland
MDPI - Multidisciplinary Digital Publishing Institute
2021
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Online toegang: | DOAB: download the publication DOAB: description of the publication |
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Samenvatting: | Over recent decades, the increase in computational resources, coupled with the popularity of competitive quantum mechanics alternatives (particularly DFT), has promoted the widespread penetration of quantum mechanics calculations into a variety of fields targeting the reactivity of molecules. This book presents a selection of original research papers and review articles illustrating diverse applications of quantum mechanics in the study of problems involving molecules and their reactivity. |
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Fysieke beschrijving: | 1 electronic resource (182 p.) |
ISBN: | books978-3-0365-0659-3 9783036506586 9783036506593 |
Toegang: | Open Access |