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Reduced Density Matrix Formulation of Quantum Linear Response.
J Chem Theory Comput. 2024 Aug 6. doi: 10.1021/acs.jctc.4c00574. Online ahead of print.
J Chem Theory Comput. 2024.
PMID: 39106406
A variational reformulation of molecular properties in electronic-structure theory.
Jørgensen P, Olsen J, Johansen MB, von Buchwald TJ, Hillers-Bendtsen AE, Mikkelsen KV, Helgaker T.
Jørgensen P, et al. Among authors: von buchwald tj.
Sci Adv. 2024 Apr 26;10(17):eadn3454. doi: 10.1126/sciadv.adn3454. Epub 2024 Apr 24.
Sci Adv. 2024.
PMID: 38657075
Free PMC article.
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The effects of solvation on the back reaction and storage capabilities of solar thermal energy storage systems.
Kjeldsen ILH, Høvring JF, von Buchwald TJ, Hillers-Bendtsen AE, Mikkelsen KV.
Kjeldsen ILH, et al. Among authors: von buchwald tj.
Phys Chem Chem Phys. 2022 Mar 2;24(9):5564-5577. doi: 10.1039/d2cp00401a.
Phys Chem Chem Phys. 2022.
PMID: 35174838
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