Carlos Vega

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All published works
Action Title Year Authors
+ PDF Chat Predictions of the interfacial free energy along the coexistence line from single-state calculations 2024 Ignacio Sanchez‐Burgos
Pablo Montero de Hijes
Eduardo Sanz
Carlos Vega
Jorge R. Espinosa
+ PDF Chat Chiral quantum optics: recent developments, and future directions 2024 D. G. SuĂĄrez-Forero
Mahmoud Jalali Mehrabad
Carlos Vega
Alejandro GonzĂĄlez-Tudela
Mohammad Hafezi
+ PDF Chat Solid-liquid interfacial free energy from computer simulations: Challenges and recent advances 2024 Nicodemo Di Pasquale
JesĂșs Algaba
Pablo Montero de Hijes
Ignacio Sanchez‐Burgos
Andrés R. Tejedor
Stephen R. Yeandel
Felipe J. Blas
Ruslan L. Davidchack
Jorge R. Espinosa
Colin L. Freeman
+ Statistical mechanics of crystal nuclei of hard spheres 2024 Marjolein de Jager
Carlos Vega
Pablo Montero de Hijes
Frank Smallenburg
Laura Filion
+ PDF Chat Predictions of the interfacial free energy along the coexistence line from single-state calculations 2024 Ignacio Sanchez‐Burgos
Pablo Montero de Hijes
Eduardo Sanz
Carlos Vega
Jorge R. Espinosa
+ PDF Chat Statistical mechanics of crystal nuclei of hard spheres 2024 Marjolein de Jager
Carlos Vega
Pablo Montero de Hijes
Frank Smallenburg
Laura Filion
+ PDF Chat Topological, multi-mode amplification induced by non-reciprocal, long-range dissipative couplings 2024 Carlos Vega
A. Muñoz de las Heras
Diego Porras
Alejandro GonzĂĄlez-Tudela
+ Variational umbrella seeding for calculating nucleation barriers 2024 Willem Gispen
Jorge R. Espinosa
Eduardo Sanz
Carlos Vega
Marjolein Dijkstra
+ Three-phase equilibria of hydrates from computer simulation. I. Finite-size effects in the methane hydrate 2024 S. Blazquez
JesĂșs Algaba
JosĂ© Manuel Mı́guez
Carlos Vega
Felipe J. Blas
M. M. Conde
+ PDF Chat Variational Umbrella Seeding for Calculating Nucleation Barriers 2024 Willem Gispen
Jorge R. Espinosa
Eduardo Sanz
Carlos Vega
Marjolein Dijkstra
+ Computation of Electrical Conductivities of Aqueous Electrolyte Solutions: Two Surfaces, One Property 2023 S. Blazquez
J. L. F. Abascal
J P Lagerweij
Parsa Habibi
Poulumi Dey
Thijs J. H. Vlugt
Othonas A. Moultos
Carlos Vega
+ Solubility of carbon dioxide in water: Some useful results for hydrate nucleation 2023 JesĂșs Algaba
IvĂĄn M. ZerĂłn
JosĂ© Manuel Mı́guez
Joanna Grabowska
S. Blazquez
Eduardo Sanz
Carlos Vega
Felipe J. Blas
+ Three phase equilibria of the methane hydrate in NaCl solutions: A simulation study 2023 S. Blazquez
Carlos Vega
M. M. Conde
+ PDF Chat Minimum in the pressure dependence of the interfacial free energy between ice Ih and water 2023 Pablo Montero de Hijes
Jorge R. Espinosa
Carlos Vega
Christoph Dellago
+ PDF Chat Melting points of water models: Current situation 2022 S. Blazquez
Carlos Vega
+ PDF Chat The Madrid-2019 force field for electrolytes in water using TIP4P/2005 and scaled charges: Extension to the ions F−, Br−, I−, Rb+, and Cs+ 2022 S. Blazquez
M. M. Conde
J. L. F. Abascal
Carlos Vega
+ Spacetime distances: an exploration 2021 Carlos Vega
+ PDF Chat “In Silico” Seawater 2021 Iván M. Zerón
Miguel A. GonzĂĄlez
Edoardo Errani
Carlos Vega
J. L. F. Abascal
+ PDF Chat Anomalous Behavior in the Nucleation of Ice at Negative Pressures 2021 Valentino Bianco
Pablo Montero de Hijes
Cintia P. Lamas
Eduardo Sanz
Carlos Vega
+ Spacetime distances: an exploration 2021 Carlos Vega
+ PDF Chat Equivalence between condensation and boiling in a Lennard-Jones fluid 2020 Ignacio Sanchez‐Burgos
Pablo Montero de Hijes
P. Rosales-Pelaez
Carlos Vega
Eduardo Sanz
+ PDF Chat The Young–Laplace equation for a solid–liquid interface 2020 Pablo Montero de Hijes
Kaihang Shi
Eva G. Noya
Erik E. Santiso
Keith E. Gubbins
Eduardo Sanz
Carlos Vega
+ PDF Chat Interfacial Free Energy and Tolman Length of Curved Liquid–Solid Interfaces from Equilibrium Studies 2020 Pablo Montero de Hijes
Jorge R. Espinosa
Valentino Bianco
Eduardo Sanz
Carlos Vega
+ PDF Chat Seeding approach to nucleation in the <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:mrow><mml:mi>N</mml:mi><mml:mi>V</mml:mi><mml:mi>T</mml:mi></mml:mrow></mml:math> ensemble: The case of bubble cavitation in overstretched Lennard Jones fluids 2020 P. Rosales-Pelaez
Ignacio Sanchez‐Burgos
Chantal Valeriani
Carlos Vega
Eduardo Sanz
+ PDF Chat Seeding approach to bubble nucleation in superheated Lennard-Jones fluids 2019 P. Rosales-Pelaez
Marta Irene GarcĂ­a Cid
Chantal Valeriani
Carlos Vega
Eduardo Sanz
+ PDF Chat A force field of Li+, Na+, K+, Mg2+, Ca2+, Cl−, and SO42− in aqueous solution based on the TIP4P/2005 water model and scaled charges for the ions 2019 Iván M. Zerón
J. L. F. Abascal
Carlos Vega
+ PDF Chat Heterogeneous <i>versus</i> homogeneous crystal nucleation of hard spheres 2019 Jorge R. Espinosa
Carlos Vega
Chantal Valeriani
Daan Frenkel
Eduardo Sanz
+ PDF Chat Homogeneous Ice Nucleation Rate in Water Droplets 2018 Jorge R. Espinosa
Carlos Vega
Eduardo Sanz
+ PDF Chat Rigidity in vacuum under conformal symmetry 2018 Gregory J. Galloway
Carlos Vega
+ PDF Chat Phase boundaries, nucleation rates and speed of crystal growth of the water-to-ice transition under an electric field: a simulation study 2018 Alberto Zaragoza
Jorge R. Espinosa
Regina Ramos
J.A. Cobos
Juan L. Aragones
Carlos Vega
Eduardo Sanz
Jorge Ramı́rez
Chantal Valeriani
+ PDF Chat A simulation study of homogeneous ice nucleation in supercooled salty water 2018 Guiomar Delgado Soria
Jorge R. Espinosa
Jorge Ramı́rez
Chantal Valeriani
Carlos Vega
Eduardo Sanz
+ PDF Chat Hausdorff Closed Limits and Rigidity in Lorentzian Geometry 2017 Gregory J. Galloway
Carlos Vega
+ Diluting the Scalability Boundaries: Exploring the Use of Disaggregated Architectures for High-Level Network Data Analysis 2017 Carlos Vega
José Fernando Zazo
Hugo Meyer
Ferad Zyulkyarov
Sergio Lopez Buedo
Javier Aracil
+ Interfacial Free Energy as the Key to the Pressure-Induced Deceleration of Ice Nucleation 2016 Jorge R. Espinosa
Alberto Zaragoza
P. Rosales-Pelaez
C. Navarro
Chantal Valeriani
Carlos Vega
Eduardo Sanz
+ PDF Chat Null distance on a spacetime 2016 Christina Sormani
Carlos Vega
+ PDF Chat Water: one molecule, two surfaces, one mistake 2015 Carlos Vega
+ PDF Chat Homogeneous ice nucleation evaluated for several water models 2014 Jorge R. Espinosa
Eduardo Sanz
Chantal Valeriani
Carlos Vega
+ PDF Chat The mold integration method for the calculation of the crystal-fluid interfacial free energy from simulations 2014 Jorge R. Espinosa
Carlos Vega
Eduardo Sanz
+ PDF Chat Achronal Limits, Lorentzian Spheres, and Splitting 2014 Gregory J. Galloway
Carlos Vega
+ PDF Chat Determining the phase diagram of water from direct coexistence simulations: The phase diagram of the TIP4P/2005 model revisited 2013 M. M. Conde
Miguel A. GonzĂĄlez
J. L. F. Abascal
Carlos Vega
+ PDF Chat Homogeneous Ice Nucleation at Moderate Supercooling from Molecular Simulation 2013 Eduardo Sanz
Carlos Vega
Jorge R. Espinosa
R. Caballero-Bernal
J. L. F. Abascal
Chantal Valeriani
+ Fluid-solid equilibrium of carbon dioxide as obtained from computer simulations of several popular potential models: The role of the quadrupole 2013 GermĂĄn PĂ©rez‐SĂĄnchez
Diego GonzĂĄlez-Salgado
Manuel M. Piñeiro
Carlos Vega
+ New Approaches to Spacetime Rigidity and Splitting 2013 Carlos Vega
+ PDF Chat Local order parameters for use in driving homogeneous ice nucleation with all-atom models of water 2012 Aleks Reinhardt
Jonathan P. K. Doye
Eva G. Noya
Carlos Vega
+ Achronal limits, Lorentzian spheres, and splitting 2012 Gregory J. Galloway
Carlos Vega
+ PDF Chat Note: Free energy calculations for atomic solids through the Einstein crystal/molecule methodology using GROMACS and LAMMPS 2012 Juan L. Aragones
Chantal Valeriani
Carlos Vega
+ PDF Chat Calculation of the melting point of alkali halides by means of computer simulations 2012 Juan L. Aragones
Eduardo Sanz
Chantal Valeriani
Carlos Vega
+ PDF Chat A study of the influence of isotopic substitution on the melting point and temperature of maximum density of water by means of path integral simulations of rigid models 2012 Carl McBride
Juan L. Aragones
Eva G. Noya
Carlos Vega
+ PDF Chat The phase diagram of water from quantum simulations 2012 Carl McBride
Eva G. Noya
Juan L. Aragones
M. M. Conde
Carlos Vega
+ Achronal limits, Lorentzian spheres, and splitting 2012 Gregory J. Galloway
Carlos Vega
+ PDF Chat Path integral Monte Carlo simulations for rigid rotors and their application to water 2010 Eva G. Noya
Luis M. Sesé
Rafael Ramı́rez
Carl McBride
M. M. Conde
Carlos Vega
+ PDF Chat The stability of a crystal with diamond structure for patchy particles with tetrahedral symmetry 2010 Eva G. Noya
Carlos Vega
Jonathan P. K. Doye
Ard A. Louis
+ PDF Chat Quantum contributions in the ice phases: The path to a new empirical model for water—TIP4PQ/2005 2009 Carl McBride
Carlos Vega
Eva G. Noya
Rafael Ramı́rez
Luis M. Sesé
+ PDF Chat Anomalies in water as obtained from computer simulations of the TIP4P/2005 model: density maxima, and density, isothermal compressibility and heat capacity minima 2009 Helena L. Pi
Juan L. Aragones
Carlos Vega
Eva G. Noya
J. L. F. Abascal
Miguel A. GonzĂĄlez
Carl McBride
+ Quantum contributions in the ice phases: the path to a new empirical model for water -- TIP4PQ/2005 2009 Carl McBride
Carlos Vega
Eva G. Noya
Rafael Ramı́rez
Luis M. Sesé
+ PDF Chat The phase diagram of water at high pressures as obtained by computer simulations of the TIP4P/2005 model: the appearance of a plastic crystal phase 2008 Juan L. Aragones
M. M. Conde
Eva G. Noya
Carlos Vega
+ PDF Chat What ice can teach us about water interactions: a critical comparison of the performance of different water models 2008 Carlos Vega
J. L. F. Abascal
M. M. Conde
Juan L. Aragones
+ PDF Chat Computing the free energy of molecular solids by the Einstein molecule approach: Ices XIII and XIV, hard-dumbbells and a patchy model of proteins 2008 Eva G. Noya
M. M. Conde
Carlos Vega
+ PDF Chat The thickness of a liquid layer on the free surface of ice as obtained from computer simulation 2008 M. M. Conde
Carlos Vega
A. Patrykiejew
+ PDF Chat Determination of phase diagrams via computer simulation: methodology and applications to water, electrolytes and proteins 2008 Carlos Vega
Eduardo Sanz
J. L. F. Abascal
Eva G. Noya
+ PDF Chat Phase diagram of model anisotropic particles with octahedral symmetry 2007 Eva G. Noya
Carlos Vega
Jonathan P. K. Doye
Ard A. Louis
+ PDF Chat Absence of superheating for ice<b><i>I<sub>h</sub></i></b>with a free surface: a new method of determining the melting point of different water models 2006 Carlos Vega
Maria Martin-Conde
A. Patrykiejew
+ PDF Chat Erratum: Solid-fluid equilibrium for a molecular model with short ranged directional forces [J. Chem. Phys. 109, 9938 (1998)] 2006 Carlos Vega
P. A. Monson
+ Non-Markovian melting: a novel procedure to generate initial liquid like phases for small molecules for use in computer simulation studies 2005 Carl McBride
Carlos Vega
Eduardo Sanz
+ The range of meta stability of ice-water melting for two simple models of water 2005 Carl McBride
Carlos Vega
Eduardo Sanz
Luis G. MacDowell
J. L. F. Abascal
+ PDF Chat The properties of fully flexible Lennard-Jones chains in the solid phase: Wertheim theory and simulation 2003 Eduardo Sanz
Carl McBride
Carlos Vega
+ PDF Chat Equation of state and critical behavior of polymer models: A quantitative comparison between Wertheim’s thermodynamic perturbation theory and computer simulations 2000 Luis G. MacDowell
Marcus MĂŒller
Carlos Vega
Kurt Binder
+ PDF Chat Vapor–liquid equilibria of linear and branched alkanes from perturbation theory 1998 Luis G. MacDowell
Carlos Vega
+ Application of Lorentz geometry to nonimaging optics: new three-dimensional ideal concentrators 1996 Manuel Gutiérrez
Juan C. Miñano
Carlos Vega
Pablo Benı́tez
+ On Rational Approximation to Semigroups of Linear Operators 1987 Arturo Ribagorda
Carlos Vega
Common Coauthors
Commonly Cited References
Action Title Year Authors # of times referenced
+ PDF Chat Homogeneous Ice Nucleation at Moderate Supercooling from Molecular Simulation 2013 Eduardo Sanz
Carlos Vega
Jorge R. Espinosa
R. Caballero-Bernal
J. L. F. Abascal
Chantal Valeriani
13
+ PDF Chat Determination of phase diagrams via computer simulation: methodology and applications to water, electrolytes and proteins 2008 Carlos Vega
Eduardo Sanz
J. L. F. Abascal
Eva G. Noya
12
+ PDF Chat What ice can teach us about water interactions: a critical comparison of the performance of different water models 2008 Carlos Vega
J. L. F. Abascal
M. M. Conde
Juan L. Aragones
12
+ PDF Chat Accurate determination of crystal structures based on averaged local bond order parameters 2008 Wolfgang Lechner
Christoph Dellago
11
+ PDF Chat Water Modeled As an Intermediate Element between Carbon and Silicon 2008 Valeria Molinero
Emily B. Moore
11
+ Interfacial Free Energy as the Key to the Pressure-Induced Deceleration of Ice Nucleation 2016 Jorge R. Espinosa
Alberto Zaragoza
P. Rosales-Pelaez
C. Navarro
Chantal Valeriani
Carlos Vega
Eduardo Sanz
9
+ PDF Chat Crystal nucleation of hard spheres using molecular dynamics, umbrella sampling, and forward flux sampling: A comparison of simulation techniques 2010 Laura Filion
Michiel Hermes
Ran Ni
Marjolein Dijkstra
7
+ PDF Chat Canonical sampling through velocity rescaling 2007 Giovanni Bussi
Davide Donadio
Michele Parrinello
7
+ P-LINCS: A Parallel Linear Constraint Solver for Molecular Simulation 2007 Berk Hess
7
+ Global Lorentzian Geometry 2017 John K. Beem
Paul E. Ehrlich
Kevin L. Easley
6
+ Direct calculation of ice homogeneous nucleation rate for a molecular model of water 2015 Amir Haji-Akbari
Pablo G. Debenedetti
6
+ PDF Chat Quantum contributions in the ice phases: The path to a new empirical model for water—TIP4PQ/2005 2009 Carl McBride
Carlos Vega
Eva G. Noya
Rafael Ramı́rez
Luis M. Sesé
6
+ The range of meta stability of ice-water melting for two simple models of water 2005 Carl McBride
Carlos Vega
Eduardo Sanz
Luis G. MacDowell
J. L. F. Abascal
6
+ PDF Chat Anomalies in water as obtained from computer simulations of the TIP4P/2005 model: density maxima, and density, isothermal compressibility and heat capacity minima 2009 Helena L. Pi
Juan L. Aragones
Carlos Vega
Eva G. Noya
J. L. F. Abascal
Miguel A. GonzĂĄlez
Carl McBride
5
+ PDF Chat Competing quantum effects in the dynamics of a flexible water model 2009 Scott Habershon
Thomas E. Markland
David E. Manolopoulos
5
+ PDF Chat Crystallization of hard spheres revisited. II. Thermodynamic modeling, nucleation work, and the surface of tension 2018 David Richard
Thomas Speck
5
+ PDF Chat Free-energy barriers for crystal nucleation from fluid phases 2017 Peter Koß
Antonia Statt
Peter Virnau
Kurt Binder
5
+ PDF Chat A route to explain water anomalies from results on an aqueous solution of salt 2010 Dario Corradini
M. Rovere
Paola Gallo
5
+ PDF Chat The mold integration method for the calculation of the crystal-fluid interfacial free energy from simulations 2014 Jorge R. Espinosa
Carlos Vega
Eduardo Sanz
5
+ PDF Chat Absence of superheating for ice<b><i>I<sub>h</sub></i></b>with a free surface: a new method of determining the melting point of different water models 2006 Carlos Vega
Maria Martin-Conde
A. Patrykiejew
5
+ PDF Chat Remarks on cosmological spacetimes and constant mean curvature surfaces 1988 Robert Bartnik
5
+ PDF Chat Finite-Size Effects on Liquid-Solid Phase Coexistence and the Estimation of Crystal Nucleation Barriers 2015 Antonia Statt
Peter Virnau
Kurt Binder
5
+ PDF Chat Homogeneous ice nucleation evaluated for several water models 2014 Jorge R. Espinosa
Eduardo Sanz
Chantal Valeriani
Carlos Vega
5
+ Escaping free-energy minima 2002 Alessandro Laio
Michele Parrinello
5
+ PDF Chat Seeding approach to nucleation in the <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:mrow><mml:mi>N</mml:mi><mml:mi>V</mml:mi><mml:mi>T</mml:mi></mml:mrow></mml:math> ensemble: The case of bubble cavitation in overstretched Lennard Jones fluids 2020 P. Rosales-Pelaez
Ignacio Sanchez‐Burgos
Chantal Valeriani
Carlos Vega
Eduardo Sanz
5
+ PDF Chat Computing the free energy of molecular solids by the Einstein molecule approach: Ices XIII and XIV, hard-dumbbells and a patchy model of proteins 2008 Eva G. Noya
M. M. Conde
Carlos Vega
5
+ The Large Scale Structure of Space-Time 1973 S. W. Hawking
George Ellis
5
+ PDF Chat Finite-size corrections to the free energies of crystalline solids 2000 James M. Polson
Emmanuel Trizac
Sander Pronk
Daan Frenkel
5
+ Some multistep methods for use in molecular dynamics calculations 1976 David Beeman
4
+ PDF Chat The thickness of a liquid layer on the free surface of ice as obtained from computer simulation 2008 M. M. Conde
Carlos Vega
A. Patrykiejew
4
+ PDF Chat Sampling Rare Switching Events in Biochemical Networks 2005 Rosalind J. Allen
Patrick B. Warren
Pieter Rein ten Wolde
4
+ PDF Chat Splitting theorems for spatially closed space-times 1984 Gregory J. Galloway
4
+ PDF Chat Molecular mechanism for cavitation in water under tension 2016 Georg Menzl
Miguel A. GonzĂĄlez
Philipp Geiger
Frédéric Caupin
J. L. F. Abascal
Chantal Valeriani
Christoph Dellago
4
+ PDF Chat A force field of Li+, Na+, K+, Mg2+, Ca2+, Cl−, and SO42− in aqueous solution based on the TIP4P/2005 water model and scaled charges for the ions 2019 Iván M. Zerón
J. L. F. Abascal
Carlos Vega
4
+ PDF Chat Accounting for electronic polarization in non-polarizable force fields 2011 Igor Leontyev
Alexei A. Stuchebrukhov
4
+ PDF Chat Rate of homogeneous crystal nucleation in molten NaCl 2005 Chantal Valeriani
Eduardo Sanz
Daan Frenkel
4
+ PDF Chat Nuclear Quantum Effects in Water 2008 Joseph A. Morrone
Roberto Car
4
+ PDF Chat Communications: Evidence for the role of fluctuations in the thermodynamics of nanoscale drops and the implications in computations of the surface tension 2010 José G. Sampayo
Alexandr MalijevskĂœ
Erich A. MĂŒller
Enrique de Miguel
George Jackson
4
+ PDF Chat A strong maximum principle for weak solutions of quasi-linear elliptic equations with applications to Lorentzian and Riemannian geometry 1998 Lars Andersson
Gregory J. Galloway
Ralph Howard
4
+ Crystal Nucleation in Liquids: Open Questions and Future Challenges in Molecular Dynamics Simulations 2016 Gabriele C. Sosso
Ji Chen
Stephen J. Cox
Martin Fitzner
Philipp Pedevilla
Andrea Zen
Angelos Michaelides
4
+ PDF Chat Regularity of Lorentzian Busemann Functions 1996 Gregory J. Galloway
Arnaldo Horta
4
+ PDF Chat Interfacial Free Energy and Tolman Length of Curved Liquid–Solid Interfaces from Equilibrium Studies 2020 Pablo Montero de Hijes
Jorge R. Espinosa
Valentino Bianco
Eduardo Sanz
Carlos Vega
4
+ PDF Chat The Young–Laplace equation for a solid–liquid interface 2020 Pablo Montero de Hijes
Kaihang Shi
Eva G. Noya
Erik E. Santiso
Keith E. Gubbins
Eduardo Sanz
Carlos Vega
4
+ PDF Chat A comparison of classical interatomic potentials applied to highly concentrated aqueous lithium chloride solutions 2017 IldikĂł Pethes
3
+ PDF Chat Temperature Dependence of Homogeneous Nucleation in Ice 2019 Haiyang Niu
Yi Yang
Michele Parrinello
3
+ PDF Chat Phase diagram of model anisotropic particles with octahedral symmetry 2007 Eva G. Noya
Carlos Vega
Jonathan P. K. Doye
Ard A. Louis
3
+ PDF Chat Boundaries of zero scalar curvature in the $\mathrm{AdS}$/$\mathrm{CFT}$ correspondence 1999 Mingliang Cai
Gregory J. Galloway
3
+ PDF Chat Simple improvements to classical bubble nucleation models 2015 Kyoko K. Tanaka
Hidekazu Tanaka
Raymond Angélil
JĂŒrg Diemand
3
+ PDF Chat Equilibrium Fluid-Solid Coexistence of Hard Spheres 2012 L. A. FernĂĄndez
V. Martı́n-Mayor
Beatriz Seoane
P. Verrocchio
3
+ PDF Chat The phase diagram of water from quantum simulations 2012 Carl McBride
Eva G. Noya
Juan L. Aragones
M. M. Conde
Carlos Vega
3