Boroxol Rings in Liquid and Vitreous from First Principles G Ferlat, T Charpentier, AP Seitsonen, A Takada, M Lazzeri, L Cormier, ... Physical review letters 101 (6), 065504, 2008 | 178 | 2008 |
Sulfur radical species form gold deposits on Earth GS Pokrovski, MA Kokh, D Guillaume, AY Borisova, P Gisquet, ... Proceedings of the National Academy of Sciences 112 (44), 13484-13489, 2015 | 173 | 2015 |
Van der Waals effects in ab initio water at ambient and supercritical conditions R Jonchiere, AP Seitsonen, G Ferlat, AM Saitta, R Vuilleumier The Journal of chemical physics 135 (15), 2011 | 172 | 2011 |
Nature of the structural transformations in B 2 O 3 glass under high pressure VV Brazhkin, Y Katayama, K Trachenko, OB Tsiok, AG Lyapin, E Artacho, ... Physical review letters 101 (3), 035702, 2008 | 103 | 2008 |
Hidden polymorphs drive vitrification in B2O3 G Ferlat, AP Seitsonen, M Lazzeri, F Mauri Nature Materials [arXiv preprint arXiv:1209.3482] 11, 925, 2012 | 91 | 2012 |
Evidence of fivefold-coordinated Ge atoms in amorphous GeO under pressure using inelastic x-ray scattering G Lelong, L Cormier, G Ferlat, V Giordano, GS Henderson, A Shukla, ... Physical Review B—Condensed Matter and Materials Physics 85 (13), 134202, 2012 | 72 | 2012 |
Navigating at will on the water phase diagram S Pipolo, M Salanne, G Ferlat, S Klotz, AM Saitta, F Pietrucci Physical review letters 119 (24), 245701, 2017 | 71 | 2017 |
Hydration of the bromine ion in a supercritical 1: 1 aqueous electrolyte G Ferlat, A San Miguel, JF Jal, JC Soetens, PA Bopp, I Daniel, S Guillot, ... Physical Review B 63 (13), 134202, 2001 | 67 | 2001 |
Density-driven structural transformations in glass A Zeidler, K Wezka, DAJ Whittaker, PS Salmon, A Baroni, S Klotz, ... Physical Review B 90 (2), 024206, 2014 | 60 | 2014 |
The structural properties of cations in nuclear glasses G Calas, L Galoisy, L Cormier, G Ferlat, G Lelong Procedia Materials Science 7, 23-31, 2014 | 60 | 2014 |
Evidence for symmetric cationic sites in zirconium-bearing oxide glasses G Ferlat, L Cormier, MH Thibault, L Galoisy, G Calas, JM Delaye, ... Physical Review B—Condensed Matter and Materials Physics 73 (21), 214207, 2006 | 60 | 2006 |
Silver in geological fluids from in situ X-ray absorption spectroscopy and first-principles molecular dynamics GS Pokrovski, J Roux, G Ferlat, R Jonchiere, AP Seitsonen, R Vuilleumier, ... Geochimica et Cosmochimica Acta 106, 501-523, 2013 | 58 | 2013 |
Liquid B2O3 up to 1700 K: x-ray diffraction and boroxol ring dissolution OLG Alderman, G Ferlat, A Baroni, M Salanne, M Micoulaut, CJ Benmore, ... Journal of Physics: Condensed Matter 27 (45), 455104, 2015 | 55 | 2015 |
Combining extended x-ray absorption fine structure with numerical simulations for disordered systems G Ferlat, JC Soetens, A San Miguel, PA Bopp Journal of Physics: Condensed Matter 17 (5), S145, 2005 | 53 | 2005 |
Remote determination of sample temperature by neutron resonance spectroscopy HJ Stone, MG Tucker, Y Le Godec, FM Meducin, ER Cope, SA Hayward, ... NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION A-ACCELERATORS …, 2005 | 47 | 2005 |
Two exchange-correlation functionals compared for first-principles liquid water MV Fernández-Serra, G Ferlat, E Artacho Molecular Simulation 31 (5), 361-366, 2005 | 45 | 2005 |
Dispersion effects in polymorphs: An ab initio study H Hay, G Ferlat, M Casula, AP Seitsonen, F Mauri Physical Review B 92 (14), 144111, 2015 | 43 | 2015 |
Ab initio studies of structural and electronic properties of solid indium selenide under pressure G Ferlat, H Xu, V Timoshevskii, X Blase Physical Review B 66 (8), 085210, 2002 | 37 | 2002 |
The quest for ion pairing in supercritical aqueous electrolytes G Ferlat, A San Miguel, JF Jal, JC Soetens, PA Bopp, JL Hazemann, ... Journal of molecular liquids 101 (1-3), 127-136, 2002 | 36 | 2002 |
Equilibrium fractionation of H and O isotopes in water from path integral molecular dynamics C Pinilla, M Blanchard, E Balan, G Ferlat, R Vuilleumier, F Mauri Geochimica et Cosmochimica Acta 135, 203-216, 2014 | 35 | 2014 |