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start [2020/04/09 18:00] tsauestart [2020/04/14 17:08] – [News] visscher
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 ===== News ===== ===== News =====
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 +2020-01-20 New paper: Susi Lehtola, Lucas Visscher, Eberhard Engel: //Efficient implementation of the superposition of atomic potentials initial guess for electronic structure calculations in Gaussian basis sets//, J. Chem. Phys. 152 (2020) 144105 [[ https://doi.org/10.1063/5.0004046|(electronic version)]])
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 2020-01-20 New paper: Nanna Holmgaard List, Timothé Romain Léo Melin, Martin van Horn and Trond Saue: //Beyond the electric-dipole approximation in simulations of X-ray absorption spectroscopy: Lessons from relativistic theory//, J. Chem. Phys. accepted. [[ https://arxiv.org/abs/2001.10738|(arXiv)]]) 2020-01-20 New paper: Nanna Holmgaard List, Timothé Romain Léo Melin, Martin van Horn and Trond Saue: //Beyond the electric-dipole approximation in simulations of X-ray absorption spectroscopy: Lessons from relativistic theory//, J. Chem. Phys. accepted. [[ https://arxiv.org/abs/2001.10738|(arXiv)]])
start.txt · Last modified: 2024/02/21 16:42 by tsaue

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