Publications
CM Publications
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| 41. |
Todorova, Mira; Neugebauer, Jörg,
Extending the Concept of Semiconductor Defect Chemistry to Electro Chemistry: A Novel Approach to Construct ab Initio Electrochemical E/pH Diagrams,
102009.
216th ECS Meeting, Vienna, Austria, 7.10.2009. (Talk)
http://edoc.mpg.de/441522 |
| 42. |
Lymperakis, Liverios; Neugebauer, Jörg,
Adatom Kinetics, Thermodynamics, and Si Incorporation on Non-Polar III-Nitride Surfaces: Implications on Nanowire Growth,
102009.
8th International Conference on Nitride Semiconductors. ICC Jeju, South Korea. 18-23.10.2009. (Talk)
http://edoc.mpg.de/443406 |
| 43. |
Hickel, Tilmann; Körmann, Fritz; Dick, Alexey; Neugebauer, Jörg,
Considerations on the magnetic contribution to the free energy of Fe and related alloys,
102009.
MCA-Fe. International workshop "Modern computational approaches in iron based alloys”. Ekaterinburg, Russia. 1-3.10.2009. (Invited talk)
http://edoc.mpg.de/443422 |
| 44. |
Dick, Alexey; Hickel, Tilmann; Neugebauer, Jörg,
Stacking Fault Energies In Austenitic FeMn Alloys: An Ab Initio Study,
102009.
Euromat 2009, Glasgow, United Kingdom. 7-10.09.2009. (Talk)
http://edoc.mpg.de/443486 |
| 45. |
Nikolov, S.; Petrov, M.; Friak, M.; Sachs, C.; Fabritius, H.; Ma, D.; Lymperakis, L.; Raabe, D.; Neugebauer, J.,
Hierarchical modeling of the elastic properties of lobster cuticle via first principles calculations and mean-field homogenization,
92009.
1st International Conference on Material Modeling. 15-17.09.2009. Dortmund, Germany. (Talk)
http://edoc.mpg.de/439018 |
| 46. |
Nikolov, S.; Petrov, M.; Friak, M.; Sachs, C.; Fabritius, H.; Ma, D.; Lymperakis, L.; Raabe, D.; Neugebauer, J.,
Multi-Scale Hierarchical Modeling of the Mechanical Properties of Lobster Cuticle,
92009.
EUROMAT 2009. 7-10.09.2009. Glasgow, United Kingdom. (Talk)
http://edoc.mpg.de/439017 |
| 47. |
Counts, W. A.; Friak, M.; Raabe, D.; Neugebauer, J.,
Theory Guided Design of Bcc Mg-Li Alloys for Ultra Light-Weight Applications,
92009.
EUROMAT 2009. 7-10.09.2009. Glasgow, United Kingdom. (Talk)
http://edoc.mpg.de/439016 |
| 48. |
Holec, D.; Friak, M.; Dlouhy, A.; Neugebauer, J.,
Ab initio search for the NiTi ground state with shape-memory ability,
92009.
ESOMAT 2009. 6-10.09.2009. Prague, Czech Republic. (Talk)
http://edoc.mpg.de/439015 |
| 49. |
Körmann, F.; Dick, A.; Grabowski, B.; Hickel, T.; Neugebauer, J.,
Towards a first-principles understanding of the iron phase diagram,
92009.
Euromat 2009. 7-10.09.2009. Glasgow, UK. (Talk)
http://edoc.mpg.de/438994 |
| 50. |
Friak, M.; Sander, B.; Ma, D.; Raabe, D.; Neugebauer, J.,
Theory-guided design of Ti-Nb alloys for biomedical applications,
92009.
1st International Conference on Material Modeling. 15-17.09.2009. Dortmund, Germany. (Poster)
http://edoc.mpg.de/439019 |
| 51. |
Counts, W. A.; Friak, M.; Raabe, D.; Neugebauer, J.,
Ab Initio Determined Materials-Design Limits in Ultra Light-Weight Mg-Li Alloys,
92009.
8th International Conference on Magnesium Alloys and their Applications. 26-29.10.2009. Weimar, Germany. (Talk)
http://edoc.mpg.de/439022 |
| 52. |
Udyansky, Alexander; von Pezold, Johann; Friák, Martin; Neugebauer, Jörg,
Influence of long-range C-C elastic interactions on the structural stability of dilute Fe-C solid solutions,
92009.
EUROMAT 2009, Glasgow, UK. 7-10.09.2009. (Talk)
http://edoc.mpg.de/441509 |
| 53. |
Dick, Alexey; Hickel, Tilmann; Neugebauer, Jörg,
Thermodynamics of high-Mn steels from ab initio theory,
92009.
Workshop of the SFB761 "Steel - ab initio", 27-30.09.2009. Salzgitter, Germany. (Talk)
http://edoc.mpg.de/443399 |
| 54. |
Hickel, Tilmann; Uijttewaal, M.; Neugebauer, Jörg,
First principles determination of phase transitions in magnetic shape memory alloys,
92009.
1st International Conference on Material Modeling, Dortmund, Germany. 15-17.09.2009. (Talk)
http://edoc.mpg.de/443419 |
| 55. |
Hickel, Tilmann; Uijttewaal, M.; Neugebauer, Jörg,
First principles determination of phase transitions in magnetic shape memory alloys,
92009.
Euromat 2009, Glasgow, United Kingdom. 7-10.09.2009. (Talk)
http://edoc.mpg.de/443420 |
| 56. |
Hickel, Tilmann; Neugebauer, Jörg,
First principles determination of phase transitions in magnetic shape memory alloys,
92009.
http://edoc.mpg.de/443421 |
| 57. |
von Pezold, Johann; Lymperakis, Liverios; Neugebauer, Jörg,
A multiscale study of the Hydrogen-enhanced local plasticity (HELP) mechanism,
92009.
Euromat 2009, Glasgow, United Kingdom. 7-10.09.2009. (Talk)
http://edoc.mpg.de/443553 |
| 58. |
Friak, M.; Deges, J.; Krein, R.; Stein, F.; Palm, M.; Frommeyer, G.; Neugebauer, J.,
Combining Experimental and Computational Methods in the Development of Fe3Al-based Materials,
92009.
5th Discussion Meeting on the Development of Innovative Iron Aluminium Alloys (FEAL 2009)
Prague, Czech Republic
http://edoc.mpg.de/446448 |
| 59. |
Friak, M.; Counts, A. W.; Raabe, D.; Neugebauer, J.,
Using Ab Initio Calculations in Designing BCC Mg-Li Alloys for Ultra Light-Weight Applications,
82009.
THERMEC'2009: International Conference on PROCESSING & MANUFACTURING OF ADVANCED MATERIALS
http://edoc.mpg.de/439003 |
| 60. |
Friak, M.; Counts, A. W.; Raabe, D.; ,
Theory guided design of bcc Mg-Li alloys for ultra-light weight applications,
82009.
ICSMA 15: International Conference on the Strength of Materials. 16-21.08.2009.Dresden, Germany. (Talk)
http://edoc.mpg.de/439001 |
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