Hochschulschrift - Master (16)

2001.
Hochschulschrift - Master
Sözen, H. I.: Ab initio investigations on the energetics and kinetics of defects in Fe–Al alloys. Master, Ruhr-Universität Bochum, Bochum, Germany (2014)
2002.
Hochschulschrift - Master
Nguyen, C.-D.: Structural interactions between solid-melt interfaces. Master, Ruhr-Universität Bochum, Bochum, Germany (2013)
2003.
Hochschulschrift - Master
Korbmacher, D.: Dual scale modeling of hydrogen embrittlement. Master, Ruhr-Universität Bochum, Bochum, Germany (2012)
2004.
Hochschulschrift - Master
Tillack, N.: Chemical Trends in the Yttrium-Oxide Precipitates in Oxide Dispersion Strengthened Steels: A First-Principles Investigation. Master, Ruhr-Universität Bochum, Bochum, Germany (2012)
2005.
Hochschulschrift - Master
Hamidi Siboni, N.: Effect of interstitials on vacancy formation and mobility in metals. Master, RWTH-Aachen, Aachen, Germany (2011)
2006.
Hochschulschrift - Master
Siboni, N. H.: Statistical and Quantum Mechanical Simulation of Interstitials in Metals - Mechanisms and Constraints for Superabundant Vacancy Formation. Master, RWTH Aachen, Institute for Computational Engineering Science, Aachen, Germany (2010)
2007.
Hochschulschrift - Master
Bubnik, V.: Visualization and Modeling of Molecules and Crystals. Master, Brno University of Technology, Brno, Czech Republic (2008)
2008.
Hochschulschrift - Master
Kim, O.: Ab-initio study of formation and interaction energies in steel and their relations to the solubility limit of carbon in austenite and ferrite. Master, RWTH-Aachen, Aachen, Germany (2007)

Hochschulschrift - Bachelor (3)

2009.
Hochschulschrift - Bachelor
Grabowski, M.: Entwicklung und Validierung DFT-basierter EAM-Potentiale. Bachelor, Heinrich-Heine-Universität, Düsseldorf, Germany (2013)
2010.
Hochschulschrift - Bachelor
Twiste, F.: Modellierung von Schmelzprozessen entlang von Korngrenzen mittels Greensfunktionsmethode. Bachelor, Heinrich-Heine Universität Düsseldorf, Düsseldorf, Germany (2012)
2011.
Hochschulschrift - Bachelor
Tillack, N.: Combined Ab Initio and Kinetic Monte-Carlo Studies on Nano-Precipitates in Steels. Bachelor, Ruhr-Universität, Bochum, Germany (2010)

Bericht (1)

2012.
Bericht
Raabe, D.; Sander, B.; Friák, M.; Ma, D.; Neugebauer, J.: Ab-initio simulation and experimental validation of beta-titanium alloys. (2008)

Zeitschrift (2)

2013.
Zeitschrift
Thermodynamics and Statistical Physics.
2014.
Zeitschrift
Thermodynamics and Statistical Physics.

Heft (1)

2015.
Heft
Alkauskas, A.; Deak, P.; Neugebauer, J.; Pasquarello, A.; van de Walle, C. G. (Hg.): Advanced Calculations for Defects in Solids - Electronic Structure Methods - Preface (Sonderheft). Physica Status Solidi B 248, (1) (2011), 17-18 S.

Sonstige (3)

2016.
Sonstige
Hübel, K.; Rohwerder, M.; Scheu, C.; Todorova, M.: Organizer of the workshop “Status and Future Challenges in Characterisation of Interfaces for Electrochemical Applications - Part 1” at the MPIE. (2016)
2017.
Sonstige
Spatschek, R.; Varnik, F.: Thermodynamics and Statistics. (2011)
2018.
Sonstige
Spatschek, R.; Varnik, F.: Thermodynamics and Statistics. (2011)

Editorial (1)

2019.
Editorial
Hickel, T.; Kattner, U. R.; Fries, S. G.: Computational Thermodynamics: Recent developments and future potential and prospects. Physica Status Solidi B 251 (1), S. 9 - 13 (2014)
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