A (nearly) universally applicable method for modeling noncovalent interactions using B3LYP E Torres, GA DiLabio The journal of physical chemistry letters 3 (13), 1738-1744, 2012 | 171 | 2012 |
Extension of the B3LYP–dispersion-correcting potential approach to the accurate treatment of both inter-and intra-molecular interactions GA DiLabio, M Koleini, E Torres Theoretical Chemistry Accounts 132, 1-13, 2013 | 58 | 2013 |
Steric and Chain Length Effects in the (√3×√3)R30° Structures of Alkanethiol Self‐Assembled Monolayers on Au (111) E Torres, AT Blumenau, PU Biedermann ChemPhysChem 12 (5), 999-1009, 2011 | 53 | 2011 |
Mechanism for phase transitions and vacancy island formation in alkylthiol/Au (111) self-assembled monolayers based on adatom and vacancy-induced reconstructions E Torres, AT Blumenau, PU Biedermann Physical Review B—Condensed Matter and Materials Physics 79 (7), 075440, 2009 | 47 | 2009 |
Fractional Fourier analysis of random signals and the notion of alpha-Stationarity of the Wigner-Ville distribution R Torres, E Torres IEEE transactions on signal processing 61 (6), 1555-1560, 2012 | 40 | 2012 |
Projector augmented-wave pseudopotentials for uranium-based compounds E Torres, TP Kaloni Computational Materials Science 171, 109237, 2020 | 35 | 2020 |
Atomistic simulation study of clustering and evolution of irradiation-induced defects in zirconium C Maxwell, J Pencer, E Torres Journal of Nuclear Materials 531, 151979, 2020 | 30 | 2020 |
Atomistic simulation study of the hydrogen diffusion in nickel E Torres, J Pencer, DD Radford Computational Materials Science 152, 374–380, 2018 | 29 | 2018 |
Molecular dynamics study of the role of symmetric tilt grain boundaries on the helium distribution in nickel E Torres, J Pencer Journal of Nuclear Materials 502, 86-94, 2018 | 28 | 2018 |
Thermal conductivity and diffusion mechanisms of noble gases in uranium dioxide: a DFT+ U study E Torres, TP Kaloni Journal of Nuclear Materials 521, 137-145, 2019 | 27 | 2019 |
Atomistic simulations and experimental measurements of helium nano-bubbles in nickel E Torres, C Judge, H Rajakumar, A Korinek, J Pencer, G Bickel Journal of Nuclear Materials 495, 475-483, 2017 | 27 | 2017 |
Comparison of Adsorption of Mercaptopropyltrimethoxysilane on Amphiphilic TiO2 and Hydroxylated SiO2 J Zuo, E Torres Langmuir 26 (19), 15161-15168, 2010 | 26 | 2010 |
Molecular dynamics study of hydrogen-vacancy interactions in α-zirconium CI Maxwell, E Torres, J Pencer Journal of Nuclear Materials 511, 341-352, 2018 | 24 | 2018 |
A density functional theory study of the reconstruction of gold (111) surfaces E Torres, GA DiLabio The Journal of Physical Chemistry C 118 (29), 15624-15629, 2014 | 24 | 2014 |
Density functional theory-based derivation of an interatomic pair potential for helium impurities in nickel E Torres, J Pencer, DD Radford Journal of Nuclear Materials 479, 240-248, 2016 | 22 | 2016 |
Fractional Sampling Theorem for -Bandlimited Random Signals and Its Relation to the von Neumann Ergodic Theorem R Torres, Z Lizarazo, E Torres IEEE Transactions on Signal Processing 62 (14), 3695-3705, 2014 | 21 | 2014 |
The role of gold adatoms in self‐assembled monolayers of thiol on Au (111) E Torres, PU Biedermann, AT Blumenau International Journal of Quantum Chemistry 109 (14), 3466-3472, 2009 | 21 | 2009 |
Thermal and mechanical properties of U3Si2: A combined ab-initio and molecular dynamics study TP Kaloni, E Torres Journal of Nuclear Materials 533, 152090, 2020 | 20 | 2020 |
A first principles investigation of the hydrogen-strain synergy on the formation and phase transition of hydrides in zirconium IC Njifon, E Torres Acta Materialia 202, 222-231, 2021 | 19 | 2021 |
A comparative analysis of the phonon properties in UO2 using the Boltzmann transport equation coupled with DFT+U and empirical potentials E Torres, I CheikNjifon, TP Kaloni, J Pencer Computational Materials Science 177, 109594, 2020 | 18 | 2020 |