A mathematical investigation of the Car-Parrinello method (Q1377020)
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scientific article; zbMATH DE number 1111580
| Language | Label | Description | Also known as |
|---|---|---|---|
| English | A mathematical investigation of the Car-Parrinello method |
scientific article; zbMATH DE number 1111580 |
Statements
A mathematical investigation of the Car-Parrinello method (English)
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1 February 1998
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molecular dynamics
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quantum adiabatic approximation
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time-dependent Born-Oppenheimer approximation
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two-time-scale asymptotics
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Car-Parrinello method
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0.82623124
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0.8243969
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0.8224473
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0.8210863
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0.8184343
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0.81722796
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