| DAMASK–The Düsseldorf Advanced Material Simulation Kit for modeling multi-physics crystal plasticity, thermal, and damage phenomena from the single crystal up to the component … F Roters, M Diehl, P Shanthraj, P Eisenlohr, C Reuber, SL Wong, T Maiti, ... Computational Materials Science 158, 420-478, 2019 | 603 | 2019 |
| The relation between ductility and stacking fault energies in Mg and Mg–Y alloys S Sandlöbes, M Friák, S Zaefferer, A Dick, S Yi, D Letzig, Z Pei, LF Zhu, ... Acta Materialia 60 (6-7), 3011-3021, 2012 | 585 | 2012 |
| Revealing the design principles of high-performance biological composites using ab initio and multiscale simulations: the example of lobster cuticle S Nikolov, M Petrov, L Lymperakis, M Friák, C Sachs, HO Fabritius, ... Advanced Materials 22 (4), 519, 2010 | 367 | 2010 |
| Ductility improvement of Mg alloys by solid solution: Ab initio modeling, synthesis and mechanical properties S Sandlöbes, Z Pei, M Friák, LF Zhu, F Wang, S Zaefferer, D Raabe, ... Acta Materialia 70, 92-104, 2014 | 307 | 2014 |
| Theory-guided bottom-up design of β-titanium alloys as biomaterials based on first principles calculations: Theory and experiments D Raabe, B Sander, M Friák, D Ma, J Neugebauer Acta Materialia 55 (13), 4475-4487, 2007 | 298 | 2007 |
| Basal and non-basal dislocation slip in Mg–Y S Sandlöbes, M Friák, J Neugebauer, D Raabe Materials Science and Engineering: A 576, 61-68, 2013 | 256 | 2013 |
| Generation and performance of special quasirandom structures for studying the elastic properties of random alloys: Application to Al-Ti J Von Pezold, A Dick, M Friák, J Neugebauer Physical Review B—Condensed Matter and Materials Physics 81 (9), 094203, 2010 | 208 | 2010 |
| Using ab initio calculations in designing bcc Mg–Li alloys for ultra-lightweight applications WA Counts, M Friak, D Raabe, J Neugebauer Acta Materialia 57 (1), 69-76, 2009 | 189 | 2009 |
| A rare-earth free magnesium alloy with improved intrinsic ductility S Sandlöbes, M Friák, S Korte-Kerzel, Z Pei, J Neugebauer, D Raabe Scientific reports 7 (1), 10458, 2017 | 176 | 2017 |
| Trends in the elastic response of binary early transition metal nitrides D Holec, M Friák, J Neugebauer, PH Mayrhofer Physical Review B—Condensed Matter and Materials Physics 85 (6), 064101, 2012 | 173 | 2012 |
| Magnetic properties of the CrMnFeCoNi high-entropy alloy O Schneeweiss, M Friák, M Dudová, D Holec, M Šob, D Kriegner, V Holý, ... Physical Review B 96 (1), 014437, 2017 | 149 | 2017 |
| Ab initio and atomistic study of generalized stacking fault energies in Mg and Mg–Y alloys Z Pei, LF Zhu, M Friák, S Sandlöbes, J von Pezold, HW Sheng, CP Race, ... New Journal of Physics 15 (4), 043020, 2013 | 133 | 2013 |
| Ab initio study of the half-metal to metal transition in strained magnetite M Friák, A Schindlmayr, M Scheffler New journal of physics 9 (1), 5, 2007 | 130 | 2007 |
| Robustness and optimal use of design principles of arthropod exoskeletons studied by ab initio-based multiscale simulations S Nikolov, H Fabritius, M Petrov, M Friák, L Lymperakis, C Sachs, ... Journal of the mechanical behavior of biomedical materials 4 (2), 129-145, 2011 | 128 | 2011 |
| Ab initio calculation of phase boundaries in iron along the bcc-fcc transformation path and magnetism of iron overlayers M Friák, M Šob, V Vitek Physical Review B 63 (5), 052405, 2001 | 117 | 2001 |
| Theory-guided materials design of multi-phase Ti-Nb alloys with bone-matching elastic properties M Friák, WA Counts, D Ma, B Sander, D Holec, D Raabe, J Neugebauer Materials 5 (10), 1853-1872, 2012 | 100 | 2012 |
| Ab initio calculation of tensile strength in iron M Friák, M Šob‖, V Vitek Philosophical Magazine 83 (31-34), 3529-3537, 2003 | 93 | 2003 |
| Chitin in the exoskeletons of arthropoda: From ancient design to novel materials science H Fabritius, C Sachs, D Raabe, S Nikolov, M Friák, J Neugebauer Chitin: Formation and diagenesis, 35-60, 2011 | 87 | 2011 |
| Ab initio calculations of elastic and magnetic properties of Fe, Co, Ni, and Cr crystals under isotropic deformation M Černý, J Pokluda, M Šob, M Friák, P Šandera Physical Review B 67 (3), 035116, 2003 | 85 | 2003 |
| The role of ab initio electronic structure calculations in studies of the strength of materials M Šob, M Friák, D Legut, J Fiala, V Vitek Materials Science and Engineering: A 387, 148-157, 2004 | 82 | 2004 |
