Finite-element methods in electronic-structure theory (Q5936512)
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scientific article; zbMATH DE number 1613456
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | Finite-element methods in electronic-structure theory |
scientific article; zbMATH DE number 1613456 |
Statements
Finite-element methods in electronic-structure theory (English)
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14 May 2002
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ab initio solid-state
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polynomials
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convergence can be controlled
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real-space-grid
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basis-oriented approaches
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ab initio calculations
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FE bases
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Schrödinger and Poisson equations
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periodic solid
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Si pseudo-charge-density
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positron distribution
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lifetime
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LMTO based
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unit cell of 4092 atoms
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