Quantum chemistry.
Overview
| Works: | 71 works in 33 publications in 33 languages | |
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Titles
The nature of the chemical bond and the structure of molecules and crystals;an introduction to modern structural chemistry.
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Recent developments and applications of modern density functional theory /
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Modern quantum chemistry :introduction to advanced electronic structure theory /
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Introduction to quantum mechanics :in chemistry, materials science, and biology /
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Principles of quantum mechanics as applied to chemistry and chemical physics /
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Methods of electronic-structure calculations :from molecules to solids /
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Explicitly correlated wave functions in chemistry and physics :theory and applications /
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Fundamentals of quantum chemistrymolecular spectroscopy and modern electronic structure computations /
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Strategies and applications in quantum chemistryfrom molecular astrophysics to molecular engineering /
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Many-body methods in chemistry and physics :MBPT and coupled-cluster theory /
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Spectroscopy, dynamics and molecular thoery of carbon plasmas and vaporsadvances in the understanding of the most complex high-temperature elemental system /
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Quantum chemistry of solidsLCAO treatment of crystals and nanostructures /
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Excitation energies and properties of open-shell singlet moleculesapplications to a new class of molecules for nonlinear optics and singlet fission /
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Relativistic quantum chemistrythe fundamental theory of molecular science /
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The union of chemistry and physicslinkages, reduction, theory nets and ontology /
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Quantum computational chemistrymodelling and calculation for functional materials /
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A quantum approach to alloy designan exploration of material design and development based upon alloy design theory and atomization energy method /
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Recent advances of the fragment molecular orbital methodenhanced performance and applicability /
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Non-covalent interactions in quantum chemistry and physicstheory and applications /
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Luminescent materialsa quantum chemical approach for computer-aided discovery and design /
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