A complete description of thermodynamic stabilities of molecular crystals

por Kapil, Venkat, Engel, Edgar A.
Publicado 2022

Thermal Engineering of Metal–Organic Frameworks for Adsorption Applications: A Molecular Simulation Perspective

por Wieme, Jelle, Vandenbrande, Steven, Lamaire, Aran, Kapil, Venkat, Vanduyfhuys, Louis, Van Speybroeck, Veronique
Publicado 2019

Simulating the ghost: quantum dynamics of the solvated electron

por Lan, Jingang, Kapil, Venkat, Gasparotto, Piero, Ceriotti, Michele, Iannuzzi, Marcella, Rybkin, Vladimir V.
Publicado 2021

Author Correction: Simulating the ghost: quantum dynamics of the solvated electron

por Lan, Jinggang, Kapil, Venkat, Gasparotto, Piero, Ceriotti, Michele, Iannuzzi, Marcella, Rybkin, Vladimir V.
Publicado 2021

Many-Body Methods for Surface Chemistry Come of Age: Achieving Consensus with Experiments

por Shi, Benjamin X., Zen, Andrea, Kapil, Venkat, Nagy, Péter R., Grüneis, Andreas, Michaelides, Angelos
Publicado 2023