Valeria Molinero
Valeria Molinero
Distinguished Professor & Jack and Peg Simons Endowed Professor of Theoretical Chemistry, U. of Utah
Correu electrònic verificat a utah.edu - Pàgina d'inici
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Water modeled as an intermediate element between carbon and silicon
V Molinero, EB Moore
The Journal of Physical Chemistry B 113 (13), 4008-4016, 2009
6982009
Structural transformation in supercooled water controls the crystallization rate of ice
EB Moore, V Molinero
Nature 479 (7374), 506-508, 2011
5172011
Nanophase-segregation and transport in Nafion 117 from molecular dynamics simulations: effect of monomeric sequence
SS Jang, V Molinero, T Çaǧın, WA Goddard
The Journal of Physical Chemistry B 108 (10), 3149-3157, 2004
4432004
Amorphous precursors in the nucleation of clathrate hydrates
LC Jacobson, W Hujo, V Molinero
Journal of the American Chemical Society 132 (33), 11806-11811, 2010
2932010
Freezing, melting and structure of ice in a hydrophilic nanopore
EB Moore, E De La Llave, K Welke, DA Scherlis, V Molinero
Physical Chemistry Chemical Physics 12 (16), 4124-4134, 2010
2222010
Vitrification of a monatomic metallic liquid
MH Bhat, V Molinero, E Soignard, VC Solomon, S Sastry, JL Yarger, ...
Nature 448 (7155), 787-790, 2007
2092007
Thermodynamic stability and growth of guest-free clathrate hydrates: a low-density crystal phase of water
LC Jacobson, W Hujo, V Molinero
The Journal of Physical Chemistry B 113 (30), 10298-10307, 2009
2082009
Modeling molecular interactions in water: From pairwise to many-body potential energy functions
GA Cisneros, KT Wikfeldt, L Ojamäe, J Lu, Y Xu, H Torabifard, AP Bartók, ...
Chemical reviews 116 (13), 7501-7528, 2016
2072016
Heterogeneous nucleation of ice on carbon surfaces
L Lupi, A Hudait, V Molinero
Journal of the American Chemical Society 136 (8), 3156-3164, 2014
1972014
Is it cubic? Ice crystallization from deeply supercooled water
EB Moore, V Molinero
Physical Chemistry Chemical Physics 13 (44), 20008-20016, 2011
1842011
Homogeneous nucleation of methane hydrates: Unrealistic under realistic conditions
BC Knott, V Molinero, MF Doherty, B Peters
Journal of the American Chemical Society 134 (48), 19544-19547, 2012
1602012
Nucleation pathways of clathrate hydrates: effect of guest size and solubility
LC Jacobson, W Hujo, V Molinero
The Journal of Physical Chemistry B 114 (43), 13796-13807, 2010
1602010
Growing correlation length in supercooled water
EB Moore, V Molinero
The Journal of chemical physics 130 (24), 244505, 2009
1602009
Stacking disorder in ice I
TL Malkin, BJ Murray, CG Salzmann, V Molinero, SJ Pickering, TF Whale
Physical Chemistry Chemical Physics 17 (1), 60-76, 2015
1592015
Ice crystallization in water’s “no-man’s land”
EB Moore, V Molinero
The Journal of chemical physics 132 (24), 244504, 2010
1512010
Tuning of tetrahedrality in a silicon potential yields a series of monatomic (metal-like) glass formers of very high fragility
V Molinero, S Sastry, CA Angell
Physical review letters 97 (7), 075701, 2006
1362006
A Methane− water model for coarse-grained simulations of solutions and clathrate hydrates
LC Jacobson, V Molinero
The Journal of Physical Chemistry B 114 (21), 7302-7311, 2010
1312010
Multi-paradigm multi-scale simulations for fuel cell catalysts and membranes
W Goddard III, B Merinov, A Van Duin, T Jacob, M Blanco, V Molinero, ...
Molecular Simulation 32 (3-4), 251-268, 2006
1282006
M3B: A coarse grain force field for molecular simulations of malto-oligosaccharides and their water mixtures
V Molinero, WA Goddard
The Journal of Physical Chemistry B 108 (4), 1414-1427, 2004
1192004
Electrostatic interactions at self assembled molecular films of charged thiols on gold
V Molinero, EJ Calvo
Journal of electroanalytical chemistry 445 (1-2), 17-25, 1998
1191998
En aquests moments el sistema no pot dur a terme l'operació. Torneu-ho a provar més tard.
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