Publications

Publications

Thesis - PhD (16)

  1. 1641.
    Thesis - PhD
    Dick, A.: Ab initio STM and STS simulations on magnetic and nonmagnetic metallic surfaces. Dissertation, University of Paderborn, Paderborn, Germany (2008)

Thesis - Diploma (4)

  1. 1642.
    Thesis - Diploma
    Hausmann, K.: Cementite in Ferrite from First-Principles: Influence of Substitutional Impurities on Thermodynamic Stability. Diploma, RWTH Aachen, Aachen, Germany (2011)
  2. 1643.
    Thesis - Diploma
    Gomoll, T.: Ab initio Berechnung von Phononenspektren in Systemen mit reduzierter Symmetrie. Diploma, Technische Fachhochschule Berlin, Berlin, Germany (2008)
  3. 1644.
    Thesis - Diploma
    Aydin, U.: Ab initio Studie der Energetik und Dynamik von Wasserstoff in Metallen. Diploma, Technische Fachhochschule Berlin, Berlin, Germany (2008)
  4. 1645.
    Thesis - Diploma
    Uchdorf, T.: Developing a general purpose database application for multiphysics. Diploma, 98 pp., Fachhochschule Aachen, Standort Jülich, Jülich, Germany (2008)

Thesis - Master (10)

  1. 1646.
    Thesis - Master
    Surendralal, S.: Automated Calculations for Charged Point Defects in Magnesium Oxide and Iron Oxides. Master, Ruhr-Universität Bochum, GermanyRuhr-Universität Bochum, Bochum, Germany (2016)
  2. 1647.
    Thesis - Master
    Gupta, A.: Precipitation Kinetics in Binary Alloys. Master, Ruhr-Universität Bochum, Bochum, Germany (2015)
  3. 1648.
    Thesis - 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)
  4. 1649.
    Thesis - Master
    Nguyen, C.-D.: Structural interactions between solid-melt interfaces. Master, Ruhr-Universität Bochum, Bochum, Germany (2013)
  5. 1650.
    Thesis - Master
    Korbmacher, D.: Dual scale modeling of hydrogen embrittlement. Master, Ruhr-Universität Bochum, Bochum, Germany (2012)
  6. 1651.
    Thesis - 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)
  7. 1652.
    Thesis - Master
    Hamidi Siboni, N.: Effect of interstitials on vacancy formation and mobility in metals. Master, RWTH-Aachen, Aachen, Germany (2011)
  8. 1653.
    Thesis - 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)
  9. 1654.
    Thesis - Master
    Bubnik, V.: Visualization and Modeling of Molecules and Crystals. Master, Brno University of Technology, Brno, Czech Republic (2008)
  10. 1655.
    Thesis - 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)

Thesis - Bachelor (3)

  1. 1656.
    Thesis - Bachelor
    Grabowski, M.: Entwicklung und Validierung DFT-basierter EAM-Potentiale. Bachelor, Heinrich-Heine-Universität, Düsseldorf, Germany (2013)
  2. 1657.
    Thesis - Bachelor
    Twiste, F.: Modellierung von Schmelzprozessen entlang von Korngrenzen mittels Greensfunktionsmethode. Bachelor, Heinrich-Heine Universität Düsseldorf, Düsseldorf, Germany (2012)
  3. 1658.
    Thesis - Bachelor
    Tillack, N.: Combined Ab Initio and Kinetic Monte-Carlo Studies on Nano-Precipitates in Steels. Bachelor, Ruhr-Universität, Bochum, Germany (2010)

Report (1)

  1. 1659.
    Report
    Raabe, D.; Sander, B.; Friák, M.; Ma, D.; Neugebauer, J.: Ab-initio simulation and experimental validation of beta-titanium alloys. (2008)

Journal (2)

  1. 1660.
    Journal
    Thermodynamics and Statistical Physics.
 
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