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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 |
pyMCD: Python package for searching transition states via the multicoordinate driven method Lee, Kyunghoon; Kim, Jun Hyeong; Kim, Woo Youn, COMPUTER PHYSICS COMMUNICATIONS, v.291, 2023-10 |
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