Veröffentlichungen

Veröffentlichungen

Poster (17)

  1. 141.
    Poster
    Todorova, M.: On the accuracy of ion hydration enegies - An ab-initio study. Gordon Research Conference ''Corrosion - Aqueous'', Colby-Sawyer College, New London, NH, USA (2012)
  2. 142.
    Poster
    Körmann, F.; Dick, A.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Atomic forces at finite magnetic temperatures: Phonons in paramagnetic iron. Calphad XLI, Berkely, CA, USA (2012)
  3. 143.
    Poster
    Kalesaki, E.; Kioseoglou, J.; Lymperakis, L.; Neugebauer, J.; Karakostas, T.; Komninou, P.: Semipolar {11-22} AlN surfaces: Morphology and electronic properties. International Conference on Extended Defects in Semiconductors, Thessaloniki, Greek (2012)
  4. 144.
    Poster
    Aydin, U.; Hickel, T.; Neugebauer, J.: Combining ab initio with data mining techniques: Solution enthalpy of hydrogen in transition metals. ADIS Conference 2012, Ringberg, Germany (2012)
  5. 145.
    Poster
    Körmann, F.; Dick, A.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Atomic forces at finite magnetic temperatures: Phonons in paramagnetic iron. ADIS Conference 2012, Ringberg, Germany (2012)
  6. 146.
    Poster
    Aydin, U.; Hickel, T.; Neugebauer, J.: Combining ab initio with data mining techniques: Solution enthalpy of hydrogen in transition metals. DPG Frühjahrstagung 2012, Berlin, Germany (2012)
  7. 147.
    Poster
    Bauer, K. D.; Todorova, M.; Hingerl, K.; Neugebauer, J.: Ab-initio Study on Liquid Metal Embrittlement in the Fe/Zn System. International Workshop on Ab initio Description of Iron and Steel (ADIS2012), Ringberg, Germany (2012)
  8. 148.
    Poster
    Bleskov, I.; Abbasi, A.; Dick, A.; Hickel, T.; Neugebauer, J.: Ab initio investigation of the stacking fault in Fe-based alloys. ADIS 2012: Ab initio Description of Iron and Steel, Ringberg, Germany (2012)
  9. 149.
    Poster
    Dutta, B.; Ghosh, S.: First-principles based modeling of lattice dynamics in disordered alloys. International Workshop on Ab initio Description of Iron and Steel (ADIS2012), Ringberg, Germany (2012)
  10. 150.
    Poster
    Dutta, B.; Hickel, T.; Al-Zubi, A.; Neugebauer, J.: Prediction of chemical trends in the phase diagrams of magnetic shape memory alloys from first-principles calculations. International Workshop on Ab initio Description of Iron and Steel (ADIS2012), Ringberg, Germany (2012)
  11. 151.
    Poster
    Glensk, A.; Grabowski, B.; Hickel, T.; Neugebauer, J.: New insights into anharmonicity. ADIS 2012: Ab initio Description of Iron and Steel, Ringberg, Germany (2012)
  12. 152.
    Poster
    Haghighat, S. M. H.; von Pezold, J.; Neugebauer, J.; Raabe, D.: Competitive glide of edge and screw dislocation in bcc-Fe. 1st Austrian-German Workshop on Computational Materials Design, Kramsach, Austria (2012)
  13. 153.
    Poster
    Nematollahi, A.; von Pezold, J.; Neugebauer, J.; Raabe, D.: Thermodynamic and kinetic effects of elastic strain on the decomposition of cementite in wire-draw pearlitic steel. International scientific seminar: Ab-initio description of iron and steel thermodynamics and kinetics, Ringberg Castle, Tegernsee, Germany (2012)
  14. 154.
    Poster
    Tillack, N.; Yates, J. R.; Roberts, S. G.; Hickel, T.; Drautz, R.; Neugebauer, J.: First-Principles Investigations of ODS Steels. Ab initio Description of Iron and Steel: Thermodynamics and Kinetics, Tegernsee, Germany (2012)

Lehrmaterial (3)

  1. 155.
    Lehrmaterial
    Hickel, T.: Introduction to Quantum Mechanics in Solid-State Physics. Vorlesung: Masterstudiengang „Materials Science and Simulation“, WS 2012/2013, Ruhr-Universität Bochum, Bochum, Germany, 01. Oktober 2012 - 31. März 2013
  2. 156.
    Lehrmaterial
    Spatschek, R. P.: Thermodynamics & Statistical Physics. Vorlesung: WS 2011/2012, Ruhr University Bochum, Bochum, Germany, 01. Oktober 2011 - 30. März 2012
  3. 157.
    Lehrmaterial
    Zaefferer, S.; Hickel, T.; Prahl, U.: Microstructures, Microscopy & Modelling. Vorlesung: Masterstudiengang, SS 2012, RWTH Aachen, Aachen, Germany, 01. April 2012 - 30. September 2012

Hochschulschrift - Doktorarbeit (1)

  1. 158.
    Hochschulschrift - Doktorarbeit
    Lange, B.: Limitierungen der p-Dotierbarkeit von Galliumnitrid: Eine Defektstudie von GaN:Mg auf Basis der Dichtefunktionaltheorie. Dissertation, Universität Paderborn, Paderborn, Germany (2012)

Hochschulschrift - Master (2)

  1. 159.
    Hochschulschrift - Master
    Korbmacher, D.: Dual scale modeling of hydrogen embrittlement. Master, Ruhr-Universität Bochum, Bochum, Germany (2012)
  2. 160.
    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)
 
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