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Dr. Pawel Rodziewicz
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Professur für Computational Chemistry
Interdisziplinäres Zentrum für Molekulare Materialien
Publications
(3)
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Journal article
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Book chapter / Article in edited volumes
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Understanding the mechanism of the sulfur mustard hydrolysis reaction on the atomistic level from experiment and first-principles simulations (2023)
Klöffel T, Gordon D, Popiel S, Nawala J, Meyer B, Rodziewicz P
Journal article
Adsorption of sulfur mustard on clean and water-saturated ZnO(101¯0): Structural diversity from first-principles calculations (2021)
Klöffel T, Kozlowska M, Popiel S, Meyer B, Rodziewicz P
Journal article
Single-walled carbon nanotubes in tetrahydrofuran solution: microsolvation from first-principles calculations (2019)
Kozlowska M, Meyer B, Rodziewicz P
Journal article