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18 Publications

2023 | Journal Article | IST-REx-ID: 12912 | OA
Schmid R, Cheng B. 2023. Computing chemical potentials of adsorbed or confined fluids. The Journal of Chemical Physics. 158(16), 161101.
[Published Version] View | Files available | DOI | WoS | PubMed | Europe PMC | arXiv
 
2023 | Journal Article | IST-REx-ID: 13039
French M, Bethkenhagen M, Ravasio A, Hernandez JA. 2023. Ab initio calculation of the reflectivity of molecular fluids under shock compression. Physical Review B. 107(13), 134109.
View | DOI | WoS
 
2023 | Journal Article | IST-REx-ID: 13231 | OA
Schörner M, Bethkenhagen M, Döppner T, Kraus D, Fletcher LB, Glenzer SH, Redmer R. 2023. X-ray Thomson scattering spectra from density functional theory molecular dynamics simulations based on a modified Chihara formula. Physical Review E. 107(6), 065207.
[Preprint] View | DOI | Download Preprint (ext.) | WoS | arXiv
 
2023 | Journal Article | IST-REx-ID: 13216 | OA
Bunting R, Wodaczek F, Torabi T, Cheng B. 2023. Reactivity of single-atom alloy nanoparticles: Modeling the dehydrogenation of propane. Journal of the American Chemical Society. 145(27), 14894–14902.
[Published Version] View | Files available | DOI | WoS | PubMed | Europe PMC
 
2023 | Journal Article | IST-REx-ID: 13118
Hernandez J-A, Bethkenhagen M, Ninet S, French M, Benuzzi-Mounaix A, Datchi F, Guarguaglini M, Lefevre F, Occelli F, Redmer R, Vinci T, Ravasio A. 2023. Melting curve of superionic ammonia at planetary interior conditions. Nature Physics. 19, 1280–1285.
View | Files available | DOI | WoS
 

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