Journal Article (581)

421.
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)
422.
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)
423.
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)
424.
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)
425.
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)
426.
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)
427.
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)
428.
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)
429.
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)
430.
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)
431.
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)
432.
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)
433.
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)
434.
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)
435.
Journal Article
Hemzalová, P.; Friák, M.; Šob, M.; Ma, D.; Udyansky, A.; Raabe, D.; Neugebauer, J.: Ab initio study of thermodynamic, electronic, magnetic, structural, and elastic properties of Ni4N allotropes. Physical Review B 88 (17), 174103 (2013)
436.
Journal Article
Barthel, S.; Schuh, K.; Marquardt, O.; Hickel, T.; Neugebauer, J.; Jahnke, F.; Czycholl, G.: Interplay between Coulomb interaction and quantum-confined Stark-effect in polar and nonpolar wurtzite InN/GaN quantum dots. European Physical Journal B 86 (11), 449 (2013)
437.
Journal Article
Körmann, F.; Grabowski, B.; Söderlind, P. A.; Palumbo, M.; Fries, S. G.; Hickel, T.; Neugebauer, J.: Thermodynamic modeling of chromium: strong and weak magnetic coupling. Journal of Physics: Condensed Matter 25 (42), 425401 (2013)
438.
Journal Article
Lymperakis, L.; Weidlich, P. H.; Eisele, H.; Schnedler, M.; Nys, J. P.; Grandidier, B.; Stiévenard, D.; Dunin-Borkowski, R. E.; Neugebauer, J.; Ebert, P.: Hidden surface states at non-polar GaN (101̄0) facets: Intrinsic pinning of nanowires. Applied Physics Letters 103 (15), 152101 (2013)
439.
Journal Article
Capiod, P.; Xu, T.; Nys, J. P.; Berthe, M.; Patriarche, G.; Lymperakis, L.; Neugebauer, J.; Caroff, P.; Dunin-Borkowski, R. E.; Ebert, P. et al.; Grandidier, B.: Band offsets at zincblende-wurtzite GaAs nanowire sidewall surfaces. Applied Physics Letters 103 (Applied Physics Letters), pp. 122104-1 - 122104-4 (2013)
440.
Journal Article
Himmerlich, M.; Lymperakis, L.; Gutt, R.; Lorenz, P.; Neugebauer, J.; Krischok, S.: GaN(0001)surface states: Experimental and theoretical fingerprints to identify surface reconstructions. Physical Review B 88 (12), 125304 (2013)
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