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Assessment and Optimization of Configurational-Bias Monte Carlo Particle Swap Strategies for Simulations of Water in the Gibbs Ensemble
American Chemical Society | 2017| -
Transferable Potentials for Phase Equilibria. 10. Explicit-Hydrogen Description of Substituted Benzenes and Polycyclic Aromatic Compounds
American Chemical Society | 2013| -
Hydrogen Sulfide Capture: From Absorption in Polar Liquids to Oxide, Zeolite, and Metal–Organic Framework Adsorbents and Membranes
American Chemical Society | 2017| -
Structure and Phase Behavior of Mixed Self-Assembled Alkanethiolate Monolayers on Gold Nanoparticles: A Monte Carlo Study
American Chemical Society | 2016| -
Ardila Hayu Tiwikrama Wins the Inaugural Journal of Chemical & Engineering Data Early Career Award
American Chemical Society | 2024| -
Announcing the Journal of Chemical & Engineering Data Early Career Award
American Chemical Society | 2023| -
Transferable Potentials for Phase Equilibria−Coarse-Grain Description for Linear Alkanes
American Chemical Society | 2011| -
TraPPE-zeo: Transferable Potentials for Phase Equilibria Force Field for All-Silica Zeolites
American Chemical Society | 2013| -
Deep neural network learning of complex binary sorption equilibria from molecular simulation data
Free accessRoyal Society of Chemistry | 2019| -
Simulating Vapor–Liquid Equilibria of PH3, AsH3, and SbH3 from First Principles
American Chemical Society | 2021|
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