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Entries: 1-7  
Theory-Guided Materials Design of Multi-Phase Ti–Nb Alloys with Bone-Matching Elastic Properties
Authors: Friak, M.; Counts, W. A.; Ma, D.; Sander, B.; Holec, D.; Raabe, D.; Neugebauer, J.
Date of Publication (YYYY-MM-DD): 2012-10
Title of Journal: Materials
Volume: 5
Issue / Number: 10
Start Page: 1853
End Page: 1872
Document Type: Article
ID: 630176.0
Trends in the elastic response of binary early transition metal nitrides
Authors: Holec, D.; Friák, M.; Neugebauer, J.; Mayrhofer, P. H.
Date of Publication (YYYY-MM-DD): 2012-02-02
Title of Journal: Physical Review B
Volume: 85
Start Page: 064101-1
End Page: 064101-9
Document Type: Article
ID: 578218.0
First-principles study of the thermodynamic and elastic properties of eutectic Fe–Ti alloy
Authors: Zhu, L.-F.; Friák, M.; Dick, A.; Grabowski, B.; Hickel, T.; Liot, F.; Holec, D.; Schlieter, A.; Kühn, U.; Eckert, J.; Ebrahimi, Z.; Emmerich, H.; Neugebauer, J.
Date of Publication (YYYY-MM-DD): 2012-02
Title of Journal: Acta Materialia
Volume: 60
Issue / Number: 4
Start Page: 1594
End Page: 1602
Document Type: Article
ID: 577829.0
Ab initio study of pressure stabilized NiTi allotropes: Pressure-induced transformations and hysteresis loops
Authors: Holec, D.; Friák, M.; Dlouhy, A.; Neugebauer, J.
Date of Publication (YYYY-MM-DD): 2011-12-28
Title of Journal: Physical Review B
Volume: 84
Start Page: 224119-1
End Page: 224119-8
Document Type: Article
ID: 576601.0
Methodological challenges in combining quantum-mechanical and continuum approaches for materials science applications
Authors: Friák, M.; Hickel, T.; Grabowski, B.; Lymperakis, L.; Udyansky, A.; Dick, A.; Ma, D.; Roters, F.; Zhu, L.-F.; Schlieter, A.; Kühn, U.; Ebrahimi, Z.; Lebensohn, R. A.; Holec, D.; Eckert, J.; Emmerich, H.; Raabe, D.; Neugebauer, J.
Date of Publication (YYYY-MM-DD): 2011-10-20
Title of Journal: European Physics Journal Plus
Volume: 126
Start Page: 101-1
End Page: 101-22
Document Type: Article
ID: 582758.0
Strain-induced effects on the electronic structure and N K-edge ELNES of wurtzite AlN and AlxGa1-xN
Authors: Petrov, M.; Holec, D.; Lymperakis, L.; Neugebauer, J.; Humphreys, C. J.
Date of Publication (YYYY-MM-DD): 2011
Name of Conference/Meeting: 17th International Conference on Microscopy of Semiconducting Materials 2011
Title of Journal: Journal of Physics Conference Series
Volume (in Journal): 326
Start Page: 012016-1
End Page: 012016-5
Document Type: Conference-Paper
ID: 625768.0
Ab initio search for the NiTi ground state with shape-memory ability
Authors: Holec, D.; Friak, M.; Dlouhy, A.; Neugebauer, J.
(Start) Date of Conference/Meeting
Name of Conference/Meeting: ESOMAT 2009
Place of Conference/Meeting: Prague, Czech Republic
Document Type: Talk at Event
ID: 439015.0
Entries: 1-7  
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