Marc Riera

Toward chemical accuracy in the description of ion–water interactions through many-body representations. Alkali-water dimer potential energy surfaces

Marc Riera, Narbe Mardirossian, Pushp Bajaj et al. · The Journal of Chemical Physics · 2017 · 129 citations

Natural Sciences, Chemistry, Physics +17

i-TTM Model for Ab Initio-Based Ion–Water Interaction Potentials. 1. Halide–Water Potential Energy Functions

Daniel J. Arismendi‐Arrieta, Marc Riera, Pushp Bajaj et al. · The Journal of Physical Chemistry B · 2015 · 91 citations

Natural Sciences, Chemistry, Physics +17

MB-pol(2023): Sub-chemical Accuracy for Water Simulations from the Gas to the Liquid Phase

Xuanyu Zhu, Marc Riera, Ethan F. Bull-Vulpe et al. · Journal of Chemical Theory and Computation · 2023 · 89 citations

Natural Sciences, Chemistry, Physics +17

Anomalies and Local Structure of Liquid Water from Boiling to the Supercooled Regime as Predicted by the Many-Body MB-pol Model

Thomas E. Gartner, Kelly M. Hunter, Eleftherios Lambros et al. · The Journal of Physical Chemistry Letters · 2022 · 87 citations · Full text

Natural Sciences, Chemistry, Physics +17

The i-TTM model for ab initio-based ion–water interaction potentials. II. Alkali metal ion–water potential energy functions

Marc Riera, Andreas W. Götz, Francesco Paesani · Physical Chemistry Chemical Physics · 2016 · 69 citations

Natural Sciences, Chemistry, Computational Chemistry +16