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Treffer Dokumente:

Erscheinungsdatum	Titel	Autor(en)
2018	Temperature dependence of the Gibbs energy of vacancy formation of fcc Ni	Gong, Yilun; Grabowski, Blazej; Glensk, Albert; Körmann, Fritz; Neugebauer, Jörg; Reed, Roger C.
2019	Fast anharmonic free energy method with an application to vacancies in ZrC	Mellan, Thomas A.; Duff, Andrew I.; Grabowski, Blazej; Finnis, Michael W.
2021	Crystal structure and phase stability of Co2N: a combined first-principles and experimental study	Ikeda, Yuji; Lehmann, Tanja S.; Widenmeyer, Marc; Coduri, Mauro; Grabowski, Blazej; Niewa, Rainer
2016	A QM/MM approach for low-symmetry defects in metals	Huber, Liam; Grabowski, Blazej; Militzer, Matthias; Neugebauer, Jörg; Rottler, Jörg
2018	A machine learning approach to model solute grain boundary segregation	Huber, Liam; Hadian, Raheleh; Grabowski, Blazej; Neugebauer, Jörg
2019	Ab initio based method to study structural phase transitions in dynamically unstable crystals, with new insights on the β to ω transformation in titanium	Korbmacher, Dominique; Glensk, Albert; Duff, Andrew Ian; Finnis, Michael W.; Grabowski, Blazej; Neugebauer, Jörg
2017	Accurate electronic free energies of the 3d, 4d, and 5d transition metals at high temperatures	Zhang, Xi; Grabowski, Blazej; Körmann, Fritz; Freysoldt, Christoph; Neugebauer, Jörg
2018	Anomalous phonon lifetime shortening in paramagnetic CrN caused by spin-lattice coupling: a combined spin and ab Initio molecular dynamics study	Stockem, Irina; Bergman, Anders; Glensk, Albert; Hickel, Tilmann; Körmann, Fritz; Grabowski, Blazej; Neugebauer, Jörg; Alling, Björn
2016	Atomic scale processes of phase transformations in nanocrystalline NiTi shape-memory alloys	Ko, Won-Seok; Maisel, Sascha B.; Grabowski, Blazej; Jeon, Jong Bae; Neugebauer, Jörg
2019	Basal slip in laves phases: the synchroshear dislocation	Guénolé, Julien; Mouhib, Fatim-Zahra; Huber, Liam; Grabowski, Blazej; Korte-Kerzel, Sandra