Talk (1155)
1221.
Talk
Enhancing mechanical properties of calcite by Mg substitutions - A Quantum-Mechanical Study. CM-Workshop, Attendorn, Germany (2011)
1222.
Talk
Magnetic systems studied by first-principles thermodynamics. CM Workshop, Akademie Biggesee, Attendorn, Germany (2011)
1223.
Talk
Thermodynamics and kinetics of hydrogen interaction with point defects. CM-Workshop, Attendorn, Germany (2011)
1224.
Talk
Role of vibrational contributions for the elastic properties of hexagonal ice. CM-Workshop, Attendorn, Germany (2011)
1225.
Talk
First principles study on Fe-Ti alloys. CM-Workshop, Attendorn, Germany (2011)
1226.
Talk
Design principles of crustacean cuticle: From molecules to skeletal elements. Workshop „From Nanoparticle Assembly to Functional Polymer Components” at Department of Geo- and Environmental Sciences, LMU, München, Germany (2011)
1227.
Talk
Ab initio up to the melting point: Anharmonicity in copper. CM-Workshop, Attendorn, Germany (2011)
1228.
Talk
Ab initio guided design of materials with superior mechanical properties. Colloquium, Institut für Technologie, Karlsruhe, Germany (2011)
1229.
Talk
Enhancing mechanical properties of calcite by Mg substitutions - A Quantum-Mechanical Study. Multi-Scale Mechanics of Biological and Bio-Inspired Hierarchical Materials and Surfaces, Glasgow, UK (2011)
1230.
Talk
Ab initio determination of point defects and derived diffusion properties in metals. 3rd Sino-German Symposium, Xi’an, Shaanxi, China (2011)
1231.
Talk
Ab initio thermodynamics: From catalytic surfaces to high-strength steels. FIESTAE Symposium, Berlin, Germany (2011)
1232.
Talk
Thermodynamic data from first principles: Achievements and challenges. Sino-German Symposium, Xi-an, China (2011)
1233.
Talk
Ab initio description of alloying effects on extended defects and interfaces. Alemi Workshop, Vancouver, BC, Canada (2011)
1234.
Talk
Stability of polar ZnO(0001) surfaces in dry and humid atmosphere. TYC Workshop ''Thermodynamics and kinetics of dopants, defects and adatoms at surfaces'' at University College London, London, UK (2011)
1235.
Talk
Computational Phase Studies: Deriving free energies and phase transitions from first principles. CECAM workshop 442: Materials Informatics: Tools for Design and Discovery, Lausanne, Switzerland (2011)
1236.
Talk
Towards an ab initio based understanding of deformation mechanisms in high-manganese Steels. 1st Int. Conf. on High Manganese Steels, Seoul, South Korea (2011)
1237.
Talk
Study of iron EAM potentials and their effects on dislocation dynamic. E-MRS Spring Meeting, Nice, France (2011)
1238.
Talk
Overview of fundamentals of first principle calculation methods. Workshop, Rio de Janeiro, Brazil (2011)
1239.
Talk
Accuracy and limitations of ab initio approaches in predicting free energies for binaries and unstable phases. CALPHAD Workshop, Rio de Janeiro, Brazil (2011)
1240.
Talk
Ab initio guided design of materials for photonic applications. Colloquium at Tyndall University, Cork, Ireland (2011)