Showing results (1-10 of 181) with videos related to

Sort By:
Pageof 19
ACS Applied Materials & Interfaces|July 2, 2024
Unveiling Competitive Adsorption in TiO2 Photocatalysis through Machine-Learning-Accelerated Molecular Dynamics, DFT, and Experimental MethodsOmar Allam, Mostafa Maghsoodi, Seung Soon Jang, et al.
Langmuir : the ACS Journal of Surfaces and Colloids|February 6, 2023
Delineating the Effects of Molecular and Colloidal Interactions of Dissolved Organic Matter on Titania PhotocatalysisMostafa Maghsoodi, Céline Jacquin, Benoit Teychené, et al.
RSC Advances|May 13, 2022
Application of DFT-based machine learning for developing molecular electrode materials in Li-ion batteriesOmar Allam, Byung Woo Cho, Ki Chul Kim, et al.
Environmental Science & Technology|January 21, 2015
Interaction of C₆₀ with water: first-principles modeling and environmental implicationsJi Il Choi, Samuel D Snow, Jae-Hong Kim, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry|June 22, 2018
Density Functional Theory - Machine Learning Approach to Analyze the Bandgap of Elemental Halide Perovskites and Ruddlesden-Popper PhasesOmar Allam, Colin Holmes, Zev Greenberg, et al.
Iscience|December 30, 2022
Optimal high-throughput virtual screening pipeline for efficient selection of redox-active organic materialsHyun-Myung Woo, Omar Allam, Junhe Chen, et al.
Environmental Science & Technology|January 31, 2015
Functionalized fullerenes in water: a closer lookSamuel D Snow, Ki Chul Kim, Kyle J Moor, et al.
The Journal of Physical Chemistry. A|September 23, 2021
DFT-Machine Learning Approach for Accurate Prediction of pKaRobin Lawler, Yao-Hao Liu, Nessa Majaya, et al.
Physical Chemistry Chemical Physics : PCCP|May 3, 2023
The selective heating effect of microwave irradiation on a binary mixture of water and polyethylene oxide: a molecular dynamics simulation approachJunhe Chen, Matthew J Warner, Benjamin Sikora, et al.
Small (Weinheim an Der Bergstrasse, Germany)|August 4, 2022
Carbon Quantum Dot Modified Reduced Graphene Oxide Framework for Improved Alkali Metal Ion Storage PerformanceShikai Jin, Omar Allam, Kyungbin Lee, et al.
Pageof 19