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Treffer 21-30 von 41 (Suchzeit: 0.001 Sekunden).
Treffer Dokumente:
ErscheinungsdatumTitelAutor(en)
2018Calculating free energies of point defects from ab initioZhang, Xi; Grabowski, Blazej; Hickel, Tilmann; Neugebauer, Jörg
2021Crystal structure and phase stability of Co2N: a combined first-principles and experimental studyIkeda, Yuji; Lehmann, Tanja S.; Widenmeyer, Marc; Coduri, Mauro; Grabowski, Blazej; Niewa, Rainer
2018A machine learning approach to model solute grain boundary segregationHuber, Liam; Hadian, Raheleh; Grabowski, Blazej; Neugebauer, Jörg
2016Atomic scale processes of phase transformations in nanocrystalline NiTi shape-memory alloysKo, Won-Seok; Maisel, Sascha B.; Grabowski, Blazej; Jeon, Jong Bae; Neugebauer, Jörg
2018Dislocation slip transmission through a coherent Σ3{111} copper twin boundary: strain rate sensitivity, activation volume and strength distribution functionMalyar, Nataliya V.; Grabowski, Blazej; Dehm, Gerhard; Kirchlechner, Christoph
2016A QM/MM approach for low-symmetry defects in metalsHuber, Liam; Grabowski, Blazej; Militzer, Matthias; Neugebauer, Jörg; Rottler, Jörg
2018GB code: a grain boundary generation codeHadian, Sherry; Grabowski, Blazej; Neugebauer, Jörg
2021Structural and magnetic properties of newly found BaFeO2.667 synthesized by oxidizing BaFeO2.5 obtained via nebulized spray pyrolysisWollstadt, Stephan; Ikeda, Yuji; Sarkar, Abhishek; Vasala, Sami; Fasel, Claudia; Alff, Lambert; Kruk, Robert; Grabowski, Blazej; Clemens, Oliver
2021A combined experimental and first-principles based assessment of finite-temperature thermodynamic properties of intermetallic Al3ScGupta, Ankit; Tas, Bengü; Korbmacher, Dominique; Dutta, Biswanath; Neitzel, Yulia; Grabowski, Blazej; Hickel, Tilmann; Esin, Vladimir; Divinski, Sergiy V.; Wilde, Gerhard; Neugebauer, Jörg
2021Finite-temperature interplay of structural stability, chemical complexity, and elastic properties of bcc multicomponent alloys from ab initio trained machine-learning potentialsGubaev, Konstantin; Ikeda, Yuji; Tasnádi, Ferenc; Neugebauer, Jörg; Shapeev, Alexander V.; Grabowski, Blazej; Körmann, Fritz

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