Veröffentlichungen

Veröffentlichungen

Poster (180)

  1. 1581.
    Poster
    Uijttewaal, M.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Towards an ab initio determination of the phase transformations of Ni2MnGa. Fokus-Treffen of the SPP 1239, Schloss Ringberg, Germany (2007)
  2. 1582.
    Poster
    Grabowski, B.; Hickel, T.; Neugebauer, J.: Accuracy and error bars of DFT calculated thermodynamic properties for elementary metals. 13th International Workshop on Computational Physics and Materials Science: Total Energy and Force Methods, Trieste, Italy (2007)
  3. 1583.
    Poster
    Hickel, T.; Grabowski, B.; Uijttewaal, M.; Neugebauer, J.: Determination of symmetry-reduced structures by a soft-phonon analysis in magnetic shape memory alloys. 13th International Workshop on Computational Physics and Materials Science: Total Energy and Force Methods, Trieste, Italy (2007)
  4. 1584.
    Poster
    Kim, O.; Friák, M.; Neugebauer, J.: Ab-initio study of formation energies in steel and their relations to the solubility limits of carbon in austenite and ferrite. Multiscale Modeling of Condensed Matter, Sant Feliu de Guixols, Spain (2007)
  5. 1585.
    Poster
    Petrov, M.; Friák, M.; Lymperakis, L.; Neugebauer, J.; Raabe, D.: An ab-initio study of hardness anisotropy of crystalline alpha-chitin. International Max-Planck Workshop on Multiscale Modeling of Condensed Matter, Sant Feliu de Guixols, Spain (2007)
  6. 1586.
    Poster
    Lymperakis, L.; Neugebauer, J.: Ab-initio based multiscale calculations of grain boundaries in Aluminium. ESOMAT 2006, Bochum, Germany (2006)
  7. 1587.
    Poster
    Abu-Farsakh, H.; Neugebauer, J.: Enhancing the solubility of N in GaAs and InAs by surface kinetics. 28th International Conference on the Physics of Semiconductors, Vienna, Austria (2006)
  8. 1588.
    Poster
    Dick, A.; Yang, R.; Yang, H.; Smith, A. R.; Neugebauer, J.: Ab-Initio Analysis of SP-STM of Mn3N2 (010) Surfaces. 4th International Conference on Scanning Probe Spectroscopy (SPS'06) and 1st International Workshop on Spin-Polarized Scanning Tunneling Microscopy (SPSTM-1), Hamburg, Germany (2006)
  9. 1589.
    Poster
    Abu-Farsakh, H.; Neugebauer, J.: Enhancing bulk solubility by surface engineering: An ab-initio study. Workshop: Ab initio Description of Iron and Steel, Status and future challenges, Ringberg Castle, Germany (2006)
  10. 1590.
    Poster
    Dick, A.; Pascual, N.; Horn, K.; Neugebauer, J.: Novel techniques to study the bulk electronic structure of metals: An ab initio based analysis of scanning tunneling microscopy. International workshop "Ab initio Description of Iron and Steel (ADIS2006), Ringberg Castle, Germany (2006)
  11. 1591.
    Poster
    Hickel, T.; Grabowski, B.; Neugebauer, J.; Neumann, B.; Neumann, K.-U.; Ziebeck, K. R. A.: Temperature dependent properties of the Heusler alloy Ni2+xMn1-xGa. International Workshop on Ab initio Description of Iron and Steel (ADIS2006), Status and future challenges, Ringberg Castle, Germany (2006)
  12. 1592.
    Poster
    Ismer, L.; Ireta, J.; Neugebauer, J.: Employing DFT and periodic boundary conditions to study the thermodynamic stability of the secondary structure of proteins. ADIS 2006, Ringberg Castle (2006)
  13. 1593.
    Poster
    Marquardt, O.: Shape effects of semiconductor quantum dots on the optical spectra. ADIS 2006, Ringberg Castle, Germany (2006)
  14. 1594.
    Poster
    Friák, M.; Neugebauer, J.; Sander, B.; Raabe, D.: Ab initio study of chemical and structural trends of Ti-based binary alloys. Materials Research Society fall meeting, Boston, MA, USA (2006)
  15. 1595.
    Poster
    Friák, M.; Neugebauer, J.: Anomalous equilibrium volume change of magnetic Fe–Al crystals. 3rd Discussion Meeting on the Development of Innovative Iron Aluminium Alloys, Mettmann, Germany (2006)
  16. 1596.
    Poster
    Lymperakis, L.; Neugebauer, J.: Exploring the 5D configurational space of grain boundaries in aluminun: An ab-initio based multiscale analysis. MRS Fall Meeting, Boston, MA, USA (2006)
  17. 1597.
    Poster
    Dick, A.; Neugebauer, J.: Probing of bulk band edges by STM: An ab initio analysis. Psi-k 2005 Conference, Schwäbisch Gmünd, Germany (2005)
  18. 1598.
    Poster
    Ismer, L.; Ireta, J.; Neugebauer, J.: Thermodynamic stability of the secondary structure of proteins: A DFT-GGA based vibrational analysis. Psi-k 2005 Conference, Schwäbisch Gmünd, Germany (2005)
  19. 1599.
    Poster
    Wahn, M.; Neugebauer, J.: Generalized Wannier Functions: An efficient way to construct ab-initio tight-binding orbitals for group-III nitrides. 6th International Conference on Nitride Semiconductors, Bremen, Germany (2005)
  20. 1600.
    Poster
    Hickel, T.; Nolting, W.: A self-consistent projection-operator approach to the Kondo-lattice model. The International Conference on Strongly Correlated Electron Systems, Vienna, Austria (2005)
 
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