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10 Publications


2021 | Journal Article | LibreCat-ID: 29701
An automated approach for developing neural network interatomic potentials with FLAME
H. Mirhosseini, H. Tahmasbi, S.R. Kuchana, A. Ghasemi, T. Kühne, Comput. Mater. Sci. 197 (2021) 110567.
LibreCat | DOI
 

2015 | Journal Article | LibreCat-ID: 10033
Modeling atomic force microscopy at LiNbO 3 surfaces from first-principles
S. Sanna, C. Dues, W.G. Schmidt, Computational Materials Science (2015) 145–150.
LibreCat | DOI
 

2015 | Journal Article | LibreCat-ID: 13504
Modeling atomic force microscopy at LiNbO 3 surfaces from first-principles
S. Sanna, C. Dues, W.G. Schmidt, Computational Materials Science 103 (2015) 145–150.
LibreCat | DOI
 

2015 | Journal Article | LibreCat-ID: 24650
Simulation of lower bainitic transformation with the phase-field method considering carbide formation
M. Düsing, R. Mahnken, Computational Materials Science (2015) 91–100.
LibreCat | DOI
 

2015 | Journal Article | LibreCat-ID: 24698
A multi-mechanism model for cutting simulations based on the concept of generalized stresses
C. Cheng, R. Mahnken, Computational Materials Science (2015) 144–158.
LibreCat | DOI
 

2011 | Journal Article | LibreCat-ID: 25085
On the simulation of austenite to bainite phase transformation
R. Mahnken, A. Schneidt, S. Tschumak, H.J. Maier, Computational Materials Science (2011) 1823–1829.
LibreCat | DOI
 

2011 | Journal Article | LibreCat-ID: 25089
A projected Newton algorithm for simulation of multi-variant textured polycrystalline shape memory alloys
R. Mahnken, S. Wilmanns, Computational Materials Science (2011) 2535–2548.
LibreCat | DOI
 

2010 | Journal Article | LibreCat-ID: 13829
First-principles investigation of CO adsorption on Pt/Ge(001)-(4×2)
A.V. Krivosheeva, S. Sanna, W.G. Schmidt, Computational Materials Science 49 (2010) 895–898.
LibreCat | DOI
 

2007 | Journal Article | LibreCat-ID: 26272
Simulation of asymmetric effects for shape memory alloys by decomposition of transformation strains
R. Mahnken, S. Wilmanns, Computational Materials Science (2007) 295–305.
LibreCat | DOI
 

2002 | Journal Article | LibreCat-ID: 13750
First-principles study of InP and GaP(001) surfaces
O. Pulci, K. Lüdge, P. Vogt, N. Esser, W.G. Schmidt, W. Richter, F. Bechstedt, Computational Materials Science (2002) 32–37.
LibreCat | DOI
 

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