Implementation of the analytic energy gradient for the combined time-dependent density functional theory/effective fragment potential method: Application to excited-state molecular dynamics simulations
2011 ◽
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(5)
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pp. 054111
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2014 ◽
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pp. 18A523
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2015 ◽
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2020 ◽
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2019 ◽
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Vol 129
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pp. 054110
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