Solving large nonlinear generalized eigenvalue problems from density functional theory calculations in parallel (Q5932824)
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scientific article; zbMATH DE number 1607456
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | Solving large nonlinear generalized eigenvalue problems from density functional theory calculations in parallel |
scientific article; zbMATH DE number 1607456 |
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Solving large nonlinear generalized eigenvalue problems from density functional theory calculations in parallel (English)
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20 June 2001
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parallel computation
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nonlinear matrix eigenproblem
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quantum mechanical ground state of electrons
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density functional theory
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self-consistent field
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large eigenvalue problems
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iterative Davidson algorithm
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eigensolution
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