Local Order of Liquid and Supercooled Zirconium by Ab Initio Molecular Dynamics N Jakse, A Pasturel
Physical review letters 91 (19), 195501, 2003
225 2003 Ab initio molecular dynamics simulations of local structure of supercooled NiN Jakse, A Pasturel
The Journal of chemical physics 120 (13), 6124-6127, 2004
134 2004 Liquid-Liquid Phase Transformation in Silicon: Evidence<? format?> from First-Principles Molecular Dynamics Simulations N Jakse, A Pasturel
Physical review letters 99 (20), 205702, 2007
126 2007 Liquid Aluminum: Atomic diffusion and viscosity from ab initio molecular dynamics N Jakse, A Pasturel
Scientific reports 3 (1), 3135, 2013
117 2013 Glass forming ability and short-range order in a binary bulk metallic glass by ab initio molecular dynamics N Jakse, A Pasturel
Applied Physics Letters 93 (11), 2008
110 2008 Local order and dynamic properties of liquid and undercooled ab initio molecular dynamics N Jakse, A Pasturel
Physical Review B—Condensed Matter and Materials Physics 78 (21), 214204, 2008
104 2008 Signatures of fragile-to-strong transition in a binary metallic glass-forming liquid KN Lad, N Jakse, A Pasturel
The Journal of chemical physics 136 (10), 2012
103 2012 Structural and dynamic evolution in liquid Au-Si eutectic alloy by ab initio molecular dynamics A Pasturel, ES Tasci, MHF Sluiter, N Jakse
Physical Review B—Condensed Matter and Materials Physics 81 (14), 140202, 2010
102 2010 Interplay between non-bridging oxygen, triclusters, and fivefold Al coordination in low silica content calcium aluminosilicate melts N Jakse, M Bouhadja, J Kozaily, JWE Drewitt, L Hennet, DR Neuville, ...
Applied Physics Letters 101 (20), 2012
100 2012 Structural changes on supercooling liquid silicon N Jakse, L Hennet, DL Price, S Krishnan, T Key, E Artacho, B Glorieux, ...
Applied physics letters 83 (23), 4734-4736, 2003
93 2003 Prediction of the local structure of liquid and supercooled tantalum N Jakse, O Le Bacq, A Pasturel
Physical Review B—Condensed Matter and Materials Physics 70 (17), 174203, 2004
87 2004 Structural and dynamic properties of calcium aluminosilicate melts: a molecular dynamics study M Bouhadja, N Jakse, A Pasturel
The Journal of chemical physics 138 (22), 2013
79 2013 Ab Initio Molecular-Dynamics Simulations of Short-Range Order <?format ?>in Liquid N Jakse, O Lebacq, A Pasturel
Physical review letters 93 (20), 207801, 2004
64 2004 Transport properties of liquid nickel near the melting point: An ab initio molecular dynamics study N Jakse, JF Wax, A Pasturel
The Journal of chemical physics 126 (23), 2007
62 2007 Excess entropy scaling law for diffusivity in liquid metals N Jakse, A Pasturel
Scientific Reports 6 (1), 20689, 2016
57 2016 Molecular-dynamics study of liquid nickel above and below the melting point N Jakse, A Pasturel
The Journal of chemical physics 123 (24), 2005
52 2005 Phase diagram of complex fluids using an efficient integral equation method I Charpentier, N Jakse
The Journal of chemical physics 123 (20), 2005
51 2005 Striking role of non-bridging oxygen on glass transition temperature of calcium aluminosilicate glass-formers M Bouhadja, N Jakse, A Pasturel
The Journal of Chemical Physics 140 (23), 2014
48 2014 Structural and dynamic origin of the boson peak in a Cu-Zr metallic glass N Jakse, A Nassour, A Pasturel
Physical Review B—Condensed Matter and Materials Physics 85 (17), 174201, 2012
42 2012 LOCAL ORDER OF LIQUID AND UNDERCOOLED TRANSITION METAL BASED SYSTEMS: AB INITIO MOLECULAR DYNAMICS STUDY N Jakse, A Pasturel
Modern Physics Letters B 20 (12), 655-674, 2006
41 2006