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Entries: 1-10  
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Enhancing mechanical properties of calcite by Mg substitutions: An ab initio study
Authors: Elstnerova, P.; Friák, M.; Hickel, T.; Fabritius, H.; Raabe, D.; Ziegler, A.; Hild, S.; Neugebauer, Jörg
(Start) Date of Event
(YYYY-MM-DD):
 2010-09-12
Name of Conference/Meeting: Psi-k Conference 2010
Document Type: Poster
ID: 498823.0
Ab Initio Guided Design of bcc Ternary Mg–Li–X (X=Ca,Al,Si,Zn,Cu) Alloys for Ultra-Lightweight Applications
Authors: Counts, W. A.; Friák, Martin; Raabe, D.; Neugebauer, Jörg
Date of Publication (YYYY-MM-DD): 2010-07
Title of Journal: Advanced Engineering Materials
Volume: 12
Issue / Number: 7
Start Page: 572
End Page: 576
Document Type: Article
ID: 494362.0
Introduction into Density Functional Theory
Authors: Neugebauer, Jörg
(Start) Date of Conference/Meeting
(YYYY-MM-DD):
 2010-06-27
Name of Conference/Meeting: Summer School on computational Materials Sciences
Place of Conference/Meeting: San Sebastian, Spain
Document Type: Talk at Event
ID: 478794.0
Charged defects in the supercell approach
Authors: Freysoldt, Christoph; Neugebauer, Jörg; Van de Walle, C. G.
(Start) Date of Conference/Meeting
(YYYY-MM-DD):
 2010-06-03
Name of Conference/Meeting: Seminar at Fritz-Haber-Institut der MPG
Place of Conference/Meeting: Berlin, Germany
Document Type: Talk at Event
ID: 491013.0
Defect distributions at III-nitride interfaces from ab-initio-based thermodynamic data
Authors: Freysoldt, Christoph; Lange, Björn; Neugebauer, Jörg
(Start) Date of Conference/Meeting
(YYYY-MM-DD):
 2010-03-22
Name of Conference/Meeting: DPG spring meeting
Place of Conference/Meeting: Regensburg, Germany
Document Type: Talk at Event
ID: 491014.0
Atomic-scale quantification of solution hardening mechanisms
Authors: von Pezold, Johann; Friák, Martin; Neugebauer, Jörg
(Start) Date of Conference/Meeting
(YYYY-MM-DD):
 2010-03-21
Name of Conference/Meeting: DPG Frühjahrstagung 2010
Place of Conference/Meeting: Regensburg, Germany
Document Type: Talk at Event
ID: 478753.0
Ab initio analysis of the carbon solubility limits in various iron allotropes
Authors: Kim, Olga; Friák, Martin; Neugebauer, Jörg
(Start) Date of Conference/Meeting
(YYYY-MM-DD):
 2010-03-21
Name of Conference/Meeting: DPG Frühjahrstagung 2010
Place of Conference/Meeting: Regensburg, Germany
Document Type: Talk at Event
ID: 478755.0
Ab-initio based multi-scale approaches to the elasticity of polycrystals
Authors: Friák, Martin; Sander, Benedikt; Ma, Duancheng; Counts, William Art; Raabe, Dierk; Neugebauer, Jörg
(Start) Date of Conference/Meeting
(YYYY-MM-DD):
 2009-07-08
Name of Conference/Meeting: Seminar at the Department of Physical Metallurgy and Materials Testing at Montan Universität Leoben
Place of Conference/Meeting: Leoben, Austria
Document Type: Talk at Event
ID: 434181.0
Challenge and opportunities for the European Steel Industry
Authors: Neugebauer, Jörg; Wuppermann, Carl-Dieter
(Start) Date of Conference/Meeting
(YYYY-MM-DD):
 2009-05-26
Name of Conference/Meeting: Asia Steel Conference
Place of Conference/Meeting: Busan, South Korea
Document Type: Talk at Event
ID: 434184.0
First-principles free-energy analysis of helix stability: The origin of the low entropy in π-helices
Authors: Ismer, Lars; Ireta, Joel; Neugebauer, Jörg
Date of Publication (YYYY-MM-DD): 2008-03-08
Title of Journal: Journal of Physical Chemistry B
Volume: 112
Start Page: 4109
End Page: 4112
Document Type: Article
ID: 362104.0
Entries: 1-10  
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