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Analytical gradients for core-excited states in the algebraic diagrammatic construction (ADC) framework Brumboiu, Iulia Emilia; Rehn, Dirk R.; Dreuw, Andreas; Rhee, Young Min; Norman, Patrick, JOURNAL OF CHEMICAL PHYSICS, v.155, no.4, 2021-07 |
eChem: A Notebook Exploration of Quantum Chemistry Fransson, Thomas; Delcey, Mickael G.; Brumboiu, Iulia Emilia; Hodecker, Manuel; Li, Xin; Rinkevicius, Zilvinas; Dreuw, Andreas; et al, JOURNAL OF CHEMICAL EDUCATION, v.100, no.4, pp.1664 - 1671, 2023-04 |
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