Electronic structure, properties, and phase stability of inorganic crystals: A pseudopotential plane‐wave study V Milman, B Winkler, JA White, CJ Pickard, MC Payne, EV Akhmatskaya, ...
International Journal of Quantum Chemistry 77 (5), 895-910, 2000
1899 2000 Rigid-unit phonon modes and structural phase transitions in framework silicates KD Hammonds, MT Dove, AP Giddy, V Heine, B Winkler
American Mineralogist 81 (9-10), 1057-1079, 1996
292 1996 Novel rhenium nitrides A Friedrich, B Winkler, L Bayarjargal, W Morgenroth, EA Juarez-Arellano, ...
Physical review letters 105 (8), 085504, 2010
166 2010 Role of disorder in the thermodynamics and atomic dynamics of glasses AI Chumakov, G Monaco, A Fontana, A Bosak, RP Hermann, D Bessas, ...
Physical Review Letters 112 (2), 025502, 2014
165 2014 Static lattice energy minimization and lattice dynamics calculations on aluminosilicate minerals B Winkler, MT Dove, M Leslie
American Mineralogist 76 (3-4), 313-331, 1991
160 1991 Pressure response of an organic− inorganic perovskite: methylammonium lead bromide IP Swainson, MG Tucker, DJ Wilson, B Winkler, V Milman
Chemistry of materials 19 (10), 2401-2405, 2007
144 2007 High-pressure polymeric nitrogen allotrope with the black phosphorus structure D Laniel, B Winkler, T Fedotenko, A Pakhomova, S Chariton, V Milman, ...
Physical review letters 124 (21), 216001, 2020
141 2020 Structural, electronic and vibrational properties of tetragonal zirconia under pressure: a density functional theory study V Milman, A Perlov, K Refson, SJ Clark, J Gavartin, B Winkler
Journal of Physics: Condensed Matter 21 (48), 485404, 2009
141 2009 Synthesis of binary transition metal nitrides, carbides and borides from the elements in the laser-heated diamond anvil cell and their structure-property relations A Friedrich, B Winkler, EA Juarez-Arellano, L Bayarjargal
Materials 4 (10), 1648-1692, 2011
138 2011 In situ IR spectroscopic and thermogravimetric study of the dehydration of gypsum A Putnis, B Winkler, L Fernandez-Diaz
Mineralogical Magazine 54 (374), 123-128, 1990
128 1990 Elastic properties of tantalum carbide (TaC) L López-de-la-Torre, B Winkler, J Schreuer, K Knorr, M Avalos-Borja
Solid State Communications 134 (4), 245-250, 2005
117 2005 Reactivity of the calcite–water-interface, from molecular scale processes to geochemical engineering F Heberling, D Bosbach, JD Eckhardt, U Fischer, J Glowacky, M Haist, ...
Applied geochemistry 45, 158-190, 2014
116 2014 Structural properties of lanthanide and actinide compounds within the plane wave pseudopotential approach CJ Pickard, B Winkler, RK Chen, MC Payne, MH Lee, JS Lin, JA White, ...
Physical review letters 85 (24), 5122, 2000
114 2000 Stiffness and thermal expansion of ZrB2: an ab initio study V Milman, B Winkler, MIJ Probert
Journal of physics: Condensed matter 17 (13), 2233, 2005
113 2005 A new interatomic potential model for calcite: applications to lattice dynamics studies, phase transition, and isotope fractionation MT Dove, B Winkler, M Leslie, MJ Harris, EKH Salje
American Mineralogist 77 (3-4), 244-250, 1992
106 1992 CaCO3 phase diagram studied with Raman spectroscopy at pressures up to 50 GPa and high temperatures and DFT modeling L Bayarjargal, CJ Fruhner, N Schrodt, B Winkler
Physics of the Earth and Planetary Interiors 281, 31-45, 2018
102 2018 The hydroxide component in synthetic pyrope CA Geiger, K Langer, DR Bell, GR Rossman, B Winkler
American Mineralogist 76 (1-2), 49-59, 1991
102 1991 On the role of Al-Si ordering in the cubic-tetragonal phase transition of leucite MT Dove, T Cool, DC Palmer, A Putnis, EKH Salje, B Winkler
American Mineralogist 78 (5-6), 486-492, 1993
93 1993 Room-Temperature Polar Order in [NH4 ][Cd(HCOO)3 ] - A Hybrid Inorganic–Organic Compound with a Unique Perovskite Architecture LC Gómez-Aguirre, B Pato-Doldán, A Stroppa, S Yáñez-Vilar, ...
Inorganic Chemistry 54 (5), 2109-2116, 2015
90 2015 Systematic prediction of crystal structures: An application to -hybridized carbon polymorphs RT Strong, CJ Pickard, V Milman, G Thimm, B Winkler
Physical Review B 70 (4), 045101, 2004
87 2004