Density functionals.
概要
| 作品: | 42 作品在 14 項出版品 14 種語言 | |
|---|---|---|
書目資訊
Contributions within density functional theory with applications in chemical reactivity theory and electronegativity /
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Principles and applications of density functional theory in inorganic chemistry II /
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Density functional theory = modeling, mathematical analysis, computational methods, and applications /
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Electronic structure calculations for solids and molecules : = theory and computational methods /
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Optimised projections for the Ab initio simulation of large and strongly correlated systems
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Density functional theory : = an advanced course / Eberhard Engel, Reiner M. Dreizler.
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A new-generation density functional = towards chemical accuracy for chemistry of main group elements /
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Principles and applications of densitiy functional theory in inorganic chemistry I
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Principles and applications of density functional theory in inorganic chemistry II
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Electronic Structure Methods for Complex Materials = The orthogonalized linear combination of atomic orbitals /
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