Fast real-time time-dependent hybrid functional calculations with the parallel transport gauge and the adaptively compressed exchange formulation (Q2696415)
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English | Fast real-time time-dependent hybrid functional calculations with the parallel transport gauge and the adaptively compressed exchange formulation |
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Fast real-time time-dependent hybrid functional calculations with the parallel transport gauge and the adaptively compressed exchange formulation (English)
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14 April 2023
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time-dependent density functional theory
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real time evolution
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hybrid exchange-correlation functional
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parallel transport gauge
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adaptively compressed exchange
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