Journal Article (587)

421.
Journal Article
Leineweber, A.; Berger, T.; Udyansky, A.; Bugaev, V. N.; Duppel, V.: The incommensurate crystal structure of the Pd5b1-z phase; B ordering driven by elastic interaction between B atoms. Zeitschrift für Kristallographie: International Journal for Structural, Physical, and Chemical Aspects of Crystalline Materials 229 (5), pp. 353 - 367 (2014)
422.
Journal Article
Nazarov, R.; Hickel, T.; Neugebauer, J.: Ab initio study of H-vacancy interactions in fcc metals: Implications for the formation of superabundant vacancies. Physical Review B 89 (14), 144108 (2014)
423.
Journal Article
Bar-Sinai, Y.; Spatschek, R. P.; Brener, E. A.; Bouchbinder, E.: On the velocity-strengthening behavior of dry friction. Journal of Geophysical Research: Solid Earth 119 (3), pp. 1738 - 1748 (2014)
424.
Journal Article
Hüter, C.; Nguyen, C.-D.; Spatschek, R. P.; Neugebauer, J.: Scale bridging between atomistic and mesoscale modelling: Applications of amplitude equation descriptions. Modelling and Simulation in Materials Science and Engineering 22 (3), 034001 (2014)
425.
Journal Article
Freysoldt, C.; Grabowski, B.; Hickel, T.; Neugebauer, J.; Kresse, G.; Janotti, A.; Van de Walle, C. G.: First-principles calculations for point defects in solids. Reviews of Modern Physics 86 (1), 253 (2014)
426.
Journal Article
Todorova, M.; Neugebauer, J.: Extending the concept of defect chemistry from semiconductor physics to electrochemistry. Physical Review Applied 1 (1), 014001 (2014)
427.
Journal Article
Duff, A.; Lymperakis, L.; Neugebauer, J.: Understanding and controlling indium incorporation and surface segregation on InxGa1-xN surfaces: An ab initio approach. Physical Review B 89 (8), 085307 (2014)
428.
Journal Article
Emmerich, H.; Virnau, P.; Wilde, G.; Spatschek, R. P.: Heterogeneous nucleation and microstructure formation: Steps towards a system and scale bridging understanding. European Physical Journal - Special Topics 223 (3), pp. 337 - 346 (2014)
429.
Journal Article
Boussinot, G.; Schulz, R.; Hüter, C.; Brener, E. A.; Spatschek, R. P.: Elastic and plastic effects on heterogeneous nucleation and nanowire formation. European Physical Journal-Special Topics 223 (3), pp. 527 - 543 (2014)
430.
Journal Article
Holec, D.; Friák, M.; Dlouhý, A.; Neugebauer, J.: Ab initio study of point defects in NiTi-based alloys. Physical Review B 89 (1), 014110 (2014)
431.
Journal Article
Schulz, T.; Duff, A.; Remmele, M.; Korytov, T.; Markut, M.; Albrecht, M.; Lymperakis, L.; Neugebauer, J.; Chèze, C.; Skierbiszewski, C.: Separating strain from composition in unit cell parameter maps obtained from aberration corrected high resolution transmission electron microscopy imaging. Journal of Applied Physics 115 (3), 033113 (2014)
432.
Journal Article
Glensk, A.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Breakdown of the Arrhenius law in describing vacancy formation energies: The importance of local anharmonicity revealed by Ab initio thermodynamics. Physical Review X 4 (1), 011018 (2014)
433.
Journal Article
Körmann, F.; Breidi, A. A. H.; Dudarev, S. L.; Dupin, N.; Ghosh, G.; Hickel, T.; Korzhavyi, P.; Muñoz, J. A.; Ohnuma, I.: Lambda transitions in materials science: Recent advances in CALPHAD and first-principles modelling. Physica Status Solidi B 251 (1), pp. 53 - 80 (2014)
434.
Journal Article
Palumbo, M.; Burton, B. P.; Costa e Silva, A. L. V.; Fultz, B. T.; Grabowski, B.; Grimvall, G.; Hallstedt, B.; Hellman, O.; Lindahl, B. B.; Schneider, A. et al.; Turchi, P. E. A.; Xiong, W.: Thermodynamic modelling of crystalline unary phases. Physica Status Solidi B 251 (1), pp. 14 - 32 (2014)
435.
Journal Article
Rogal, J.; Divinski, S. V.; Finnis, M. W.; Glensk, A.; Neugebauer, J.; Perepezko, J. H.; Schuwalow, S.; Sluiter, M. H. F.; Sundman, B. O.: Perspectives on point defect thermodynamics. Physica Status Solidi B 251 (1), pp. 97 - 129 (2014)
436.
Journal Article
Zhu, L.-F.; Friák, M.; Udyansky, A.; Ma, D.; Schlieter, A.; Kühn, U.; Eckert, J.; Neugebauer, J.: Ab initio based study of finite-temperature structural, elastic and thermodynamic properties of FeTi. Intermetallics 45, pp. 11 - 17 (2014)
437.
Journal Article
Bar-Sinai, Y.; Spatschek, R. P.; Brener, E. A.; Bouchbinder, E.: Erratum: Instabilities at frictional interfaces: Creep patches, nucleation, and rupture fronts (Physical Review E (2013) 88 (060403(R)) DOI:10.1103/PhysRevE.88.060403). Physical Review E 88 (6), 069905 (2013)
438.
Journal Article
Zhang, S.; Zhang, Y.; Cui, Y.; Freysoldt, C.; Neugebauer, J.; Lieten, R. R.; Barnard, J. S.; Humphreys, C. J.: Interface structure and chemistry of GaN on Ge(111). Physical Review Letters 111 (25), 256101 (2013)
439.
Journal Article
Bar-Sinai, Y.; Spatschek, R. P.; Brener, E. A.; Bouchbinder, E.: Instabilities at frictional interfaces: Creep patches, nucleation, and rupture fronts. Physical Review E 88 (6), 060403 (2013)
440.
Journal Article
Nykänen, L.; Honkala, K.: Selectivity in propene dehydrogenation on Pt and Pt3Sn surfaces from first principles. ACS Catalysis 3 (12), pp. 3026 - 3030 (2013)
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