Daniel Schärf - Publications

2010-2014 Chemistry Johannes Gutenberg Universität Mainz, Germany 

3 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2012 Pascal TA, Schärf D, Jung Y, Kühne TD. On the absolute thermodynamics of water from computer simulations: a comparison of first-principles molecular dynamics, reactive and empirical force fields. The Journal of Chemical Physics. 137: 244507. PMID 23277945 DOI: 10.1063/1.4771974  0.36
2012 Wehmeyer C, Falk von Rudorff G, Wolf S, Kabbe G, Schärf D, Kühne TD, Sebastiani D. Foraging on the potential energy surface: a swarm intelligence-based optimizer for molecular geometry. The Journal of Chemical Physics. 137: 194110. PMID 23181297 DOI: 10.1063/1.4766821  0.36
2010 Chadov S, Schärf D, Fecher GH, Felser C, Zhang L, Singh DJ. Electronic structure, localization, and spin-state transition in Cu-substituted FeSe: Fe1-x Cux Se Physical Review B - Condensed Matter and Materials Physics. 81. DOI: 10.1103/PhysRevB.81.104523  0.36
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