Publications of J. Neugebauer
All genres
Poster (168)
1481.
Poster
Towards an ab initio determination of the phase transformations of Ni2MnGa. Fokus-Treffen of the SPP 1239, Schloss Ringberg, Germany (2007)
1482.
Poster
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)
1483.
Poster
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)
1484.
Poster
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)
1485.
Poster
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)
1486.
Poster
Ab-initio based multiscale calculations of grain boundaries in Aluminium. ESOMAT 2006, Bochum, Germany (2006)
1487.
Poster
Enhancing the solubility of N in GaAs and InAs by surface kinetics. 28th International Conference on the Physics of Semiconductors, Vienna, Austria (2006)
1488.
Poster
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)
1489.
Poster
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)
1490.
Poster
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)
1491.
Poster
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)
1492.
Poster
Employing DFT and periodic boundary conditions to study the thermodynamic stability of the secondary structure of proteins. ADIS 2006, Ringberg Castle (2006)
1493.
Poster
Anomalous equilibrium volume change of magnetic Fe–Al crystals. 3rd Discussion Meeting on the Development of Innovative Iron Aluminium Alloys, Mettmann, Germany (2006)
1494.
Poster
Ab initio study of chemical and structural trends of Ti-based binary alloys. Materials Research Society fall meeting, Boston, MA, USA (2006)
1495.
Poster
Exploring the 5D configurational space of grain boundaries in aluminun: An ab-initio based multiscale analysis. MRS Fall Meeting, Boston, MA, USA (2006)
1496.
Poster
Probing of bulk band edges by STM: An ab initio analysis. Psi-k 2005 Conference, Schwäbisch Gmünd, Germany (2005)
1497.
Poster
Thermodynamic stability of the secondary structure of proteins: A DFT-GGA based vibrational analysis. Psi-k 2005 Conference, Schwäbisch Gmünd, Germany (2005)
1498.
Poster
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)
1499.
Poster
Temperature dependent properties of Ni-rich Ni2MnGa. Materials Research Society fall meeting, Boston, MA, USA (2005)
1500.
Poster
Thermodynamic stability of the secondary structure of proteins: A DFT-GGA based vibrational analysis. IPAM-Workshop: Multiscale Modeling in Soft Matter and Bio-Physics, Los Angeles, CA, USA (2005)