Ab initio full-potential study of the structural and magnetic phase stability of ironHC Herper, E Hoffmann, P Entel
Physical Review B 60 (6), 3839, 1999
463 1999 Modelling the phase diagram of magnetic shape memory Heusler alloys P Entel, VD Buchelnikov, VV Khovailo, AT Zayak, WA Adeagbo, ...
Journal of Physics D: Applied Physics 39 (5), 865, 2006
421 2006 First-principles and Monte Carlo study of magnetostructural transition and magnetocaloric properties of VD Buchelnikov, VV Sokolovskiy, HC Herper, H Ebert, ME Gruner, ...
Physical Review B—Condensed Matter and Materials Physics 81 (9), 094411, 2010
158 2010 Designing shape-memory Heusler alloys from first-principles M Siewert, ME Gruner, A Dannenberg, A Chakrabarti, HC Herper, ...
Applied Physics Letters 99 (19), 2011
121 2011 Complex magnetic ordering as a driving mechanism of multifunctional properties of Heusler alloys from first principles P Entel, M Siewert, ME Gruner, HC Herper, D Comtesse, R Arróyave, ...
The European Physical Journal B 86, 1-11, 2013
94 2013 Graphene as a reversible spin manipulator of molecular magnets S Bhandary, S Ghosh, H Herper, H Wende, O Eriksson, B Sanyal
Physical review letters 107 (25), 257202, 2011
88 2011 A First‐Principles Investigation of the Compositional Dependent Properties of Magnetic Shape Memory Heusler Alloys M Siewert, ME Gruner, A Hucht, HC Herper, A Dannenberg, A Chakrabarti, ...
Advanced Engineering Materials 14 (8), 530-546, 2012
73 2012 Influence of electron correlation on the electronic structure and magnetism of transition-metal phthalocyanines IE Brumboiu, S Haldar, J Luder, O Eriksson, HC Herper, B Brena, ...
Journal of Chemical Theory and Computation 12 (4), 1772-1785, 2016
70 2016 Fundamental Aspects of Magnetic Shape Memory Alloys: Insights from Ab Initio and Monte Carlo Studies P Entel, ME Gruner, A Dannenberg, M Siewert, SK Nayak, HC Herper, ...
Materials Science Forum 635, 3-12, 2010
64 2010 Intrinsic magnetic properties of SmFe12− xVx alloys with reduced V-concentration AM Schönhöbel, R Madugundo, OY Vekilova, O Eriksson, HC Herper, ...
Journal of Alloys and Compounds 786, 969-974, 2019
58 2019 Elucidating the 3d electronic configuration in manganese phthalocyanine IE Brumboiu, R Totani, M de Simone, M Coreno, C Grazioli, L Lozzi, ...
The Journal of Physical Chemistry A 118 (5), 927-932, 2014
58 2014 High-throughput and data-mining approach to predict new rare-earth free permanent magnets A Vishina, OY Vekilova, T Björkman, A Bergman, HC Herper, O Eriksson
Physical Review B 101 (9), 094407, 2020
51 2020 Database of novel magnetic materials for high-performance permanent magnet development P Nieves, S Arapan, J Maudes-Raedo, R Marticorena-Sánchez, ...
Computational materials science 168, 188-202, 2019
51 2019 Martensitic transformations: first-principles calculations combined with molecular-dynamics simulations P Entel, R Meyer, K Kadau, HC Herper, E Hoffmann
The European Physical Journal B-Condensed Matter and Complex Systems 5, 379-388, 1998
51 1998 Composition-dependent basics of smart Heusler materials from first-principles calculations P Entel, A Dannenberg, M Siewert, HC Herper, ME Gruner, ...
Materials Science Forum 684, 1-29, 2011
47 2011 Oxygen-tuned magnetic coupling of Fe-phthalocyanine molecules to ferromagnetic Co films D Klar, B Brena, HC Herper, S Bhandary, C Weis, B Krumme, ...
Physical Review B 88 (22), 224424, 2013
46 2013 Microscopic theory of the martensitic transition in E Hoffmann, H Herper, P Entel, SG Mishra, P Mohn, K Schwarz
Physical Review B 47 (10), 5589, 1993
44 1993 Iron porphyrin molecules on Cu (001): Influence of adlayers and ligands on the magnetic properties HC Herper, M Bernien, S Bhandary, CF Hermanns, A Krüger, J Miguel, ...
Physical Review B—Condensed Matter and Materials Physics 87 (17), 174425, 2013
43 2013 Local atomic order and element-specific magnetic moments of B Krumme, C Weis, HC Herper, F Stromberg, C Antoniak, A Warland, ...
Physical Review B—Condensed Matter and Materials Physics 80 (14), 144403, 2009
42 2009 Basic properties of magnetic shape-memory materials from first-principles calculations P Entel, A Dannenberg, M Siewert, HC Herper, ME Gruner, D Comtesse, ...
Metallurgical and Materials Transactions A 43, 2891-2900, 2012
40 2012