| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5384946 | Chemical Physics Letters | 2010 | 5 Pages |
Abstract
⺠Response equation extrapolation reduces number of cycles to 1-2. ⺠Accelerates correlated-wavefunction molecular dynamics, such as MP2. ⺠Applicable to any correlated method in which molecular orbitals are not fully optimized.
Related Topics
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Authors
Ryan P. Steele, John C. Tully,