Transition metal-doped TiO2 and ZnO—present status of the field R Janisch, P Gopal, NA Spaldin Journal of Physics: Condensed Matter 17 (27), R657, 2005 | 782 | 2005 |
Understanding ferromagnetism in Co-doped anatase from first principles R Janisch, NA Spaldin Physical Review B 73 (3), 035201, 2006 | 135 | 2006 |
First-principles study of carbon segregation in bcc iron symmetrical tilt grain boundaries J Wang, R Janisch, GKH Madsen, R Drautz Acta Materialia 115, 259-268, 2016 | 106 | 2016 |
Hydrogen embrittlement of a carbon segregated Σ5 (310)[001] symmetrical tilt grain boundary in α-Fe AM Tahir, R Janisch, A Hartmaier Materials Science and Engineering: A 612, 462-467, 2014 | 73 | 2014 |
Ab initio tensile tests of Al bulk crystals and grain boundaries: Universality of mechanical behavior R Janisch, N Ahmed, A Hartmaier Physical Review B 81 (18), 184108, 2010 | 73 | 2010 |
Ab initio calculation of traction separation laws for a grain boundary in molybdenum with segregated C impurites AM Tahir, R Janisch, A Hartmaier Modelling and Simulation in Materials Science and Engineering 21 (7), 075005, 2013 | 71 | 2013 |
Stacking fault based analysis of shear mechanisms at interfaces in lamellar TiAl alloys M Kanani, A Hartmaier, R Janisch Acta Materialia 106, 208-218, 2016 | 62 | 2016 |
Solubility of carbon in α-iron under volumetric strain and close to the Σ5 (3 1 0)[0 0 1] grain boundary: Comparison of DFT and empirical potential methods E Hristova, R Janisch, R Drautz, A Hartmaier Computational Materials Science 50 (3), 1088-1096, 2011 | 62 | 2011 |
Segregated light elements at grain boundaries in niobium and molybdenum R Janisch, C Elsässer Physical Review B 67 (22), 224101, 2003 | 61 | 2003 |
Simulation of fracture in heterogeneous elastic materials with cohesive zone models M Prechtel, PL Ronda, R Janisch, A Hartmaier, G Leugering, P Steinmann, ... International Journal of Fracture 168, 15-29, 2011 | 46 | 2011 |
Amorphization-governed elasto-plastic deformation under nanoindentation in cubic (3C) silicon carbide L Zhao, M Alam, J Zhang, R Janisch, A Hartmaier Ceramics International 46 (8), 12470-12479, 2020 | 45 | 2020 |
Interface properties in lamellar TiAl microstructures from density functional theory M Kanani, A Hartmaier, R Janisch Intermetallics 54, 154-163, 2014 | 41 | 2014 |
Structure, structural phase transitions, mechanical properties, defects, etc.-Segregated light elements at grain boundaries in niobium and molybdenum R Janisch, C Elsasser Physical Review-Section B-Condensed Matter 67 (22), 224101-224101, 2003 | 38 | 2003 |
Twin-boundary assisted crack tip plasticity and toughening in lamellar γ-TiAl A Neogi, R Janisch Acta Materialia 213, 116924, 2021 | 27 | 2021 |
Growth and mechanical properties of a MoC precipitate at a Mo grain boundary: An ab initio density functional theory study R Janisch, C Elsässer Physical Review B 77 (9), 094118, 2008 | 21 | 2008 |
ul Hassan, H.; Hartmaier, A. Fracture ab initio: A force-based scaling law for atomistically informed continuum models JJ Möller, E Bitzek, R Janisch J. Mater. Res 33, 3750-3761, 2018 | 19 | 2018 |
The role of silicon, vacancies, and strain in carbon distribution in low temperature bainite S Sampath, R Rementeria, X Huang, JD Poplawsky, C Garcia-Mateo, ... Journal of Alloys and Compounds 673, 289-294, 2016 | 19 | 2016 |
Fracture ab initio: A force-based scaling law for atomistically informed continuum models JJ Möller, E Bitzek, R Janisch, H ul Hassan, A Hartmaier Journal of Materials Research 33 (22), 3750-3761, 2018 | 18 | 2018 |
Interstitial impurities at grain boundaries in metals: insight from atomistic calculations R Janisch, C Elsässer International journal of materials research 100 (11), 1488-1493, 2009 | 18 | 2009 |
Density-functional investigation of the twin grain boundary in Co-doped anatase and its influence on magnetism in dilute magnetic semiconductors S Gemming, R Janisch, M Schreiber, NA Spaldin Physical Review B 76 (4), 045204, 2007 | 17 | 2007 |