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Scalar Relativistic Effects with Multiwavelets: Implementation and Benchmark.
Brakestad A, Jensen SR, Tantardini C, Pitteloud Q, Wind P, Užulis J, Gulans A, Hopmann KH, Frediani L. Brakestad A, et al. Among authors: hopmann kh. J Chem Theory Comput. 2024 Jan 23;20(2):728-737. doi: 10.1021/acs.jctc.3c01095. Epub 2024 Jan 5. J Chem Theory Comput. 2024. PMID: 38181377 Free PMC article.
Room-Temperature-Stable Magnesium Electride via Ni(II) Reduction.
Day CS, Do CD, Odena C, Benet-Buchholz J, Xu L, Foroutan-Nejad C, Hopmann KH, Martin R. Day CS, et al. Among authors: hopmann kh. J Am Chem Soc. 2022 Jul 27;144(29):13109-13117. doi: 10.1021/jacs.2c01807. Epub 2022 Jul 13. J Am Chem Soc. 2022. PMID: 35830190 Free PMC article.
45 results