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Showing 2017 · physics.chem-phShow all
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physics.chem-ph2017★ 44 cited
Exact time-dependent exchange-correlation potential in electron scattering processes
Yasumitsu Suzuki, Lionel Lacombe, Kazuyuki Watanabe +1
We identify peak and valley structures in the exact exchange-correlation potential of time-dependent density functional theory that are crucial for time-resolved electron scatterin…
physics.chem-ph2017★ 131 cited
Charge-Transfer in Time-Dependent Density Functional Theory
Neepa T. Maitra
Charge transfer plays a crucial role in many processes of interest in physics, chemistry, and bio-chemistry. In many applications the size of the systems involved calls for time-de…