Showing results (1-10 of 8) with videos related to
Sort By:
Pageof 1
Faraday Discussions|October 27, 2020
Influence of flexible side-chains on the breathing phase transition of pillared layer MOFs: a force field investigationJulian Keupp, Johannes P Dürholt, Rochus SchmidDalton Transactions (Cambridge, England : 2003)|January 7, 2016
Coarse graining of force fields for metal-organic frameworksJohannes P Dürholt, Raimondas Galvelis, Rochus SchmidACS Central Science|September 5, 2019
Tuning the Electric Field Response of MOFs by Rotatable Dipolar LinkersJohannes P Dürholt, Babak Farhadi Jahromi, Rochus SchmidJournal of Chemical Theory and Computation|March 14, 2019
Ab Initio Derived Force Fields for Zeolitic Imidazolate Frameworks: MOF-FF for ZIFsJohannes P Dürholt, Guillaume Fraux, François-Xavier Coudert, et al.Nature Communications|July 17, 2024
Learning a reactive potential for silica-water through uncertainty attributionSwagata Roy, Johannes P Dürholt, Thomas S Asche, et al.Journal of Chemical Theory and Computation|March 11, 2020
Evaluating Computational Shortcuts in Supercell-Based Phonon Calculations of Molecular Crystals: The Instructive Case of NaphthaleneTomas Kamencek, Sandro Wieser, Hirotaka Kojima, et al.Nature Communications|July 28, 2016
Pentlandite rocks as sustainable and stable efficient electrocatalysts for hydrogen generationBharathi Konkena, Kai Junge Puring, Ilya Sinev, et al.Journal of the American Chemical Society|June 11, 2014
Structural complexity in metal-organic frameworks: simultaneous modification of open metal sites and hierarchical porosity by systematic doping with defective linkersZhenlan Fang, Johannes P Dürholt, Max Kauer, et al.Pageof 1