Randall Q. Snurr

Available identifiers

Publication	Date of Publication	Type
Supplementary Data for Paper "Small Rotations, Big Effects: Lessons from Water Adsorption in NU-1000"	2025-01-15	Dataset
Computational Chemistry and Machine Learning-assisted Screening of Supported Amorphous Metal Oxide Nanoclusters for Methane Activation	2024-06-29	Dataset
Supplementary Data for "Exploring the Chemical Space of Metal–Organic Frameworks with rht Topology for High Capacity Hydrogen Storage"	2024-04-29	Dataset
Computational Screening of Supported Metal Oxide Nanoclusters for Methane Activation: Insights into Homolytic versus Heterolytic C-H Bond Dissociation	2023-05-10	Dataset
Dataset for "Fine-Tuning A Robust Metal–Organic Framework Towards Enhanced Clean Energy Gas Storage"	2021-10-04	Dataset
Supplementary Data for "Structure−Activity Relationships that Identify Metal−Organic Framework Catalysts for Methane Activation"	2019-03-23	Dataset
Supplementary Data for "Comprehensive Phase Diagrams of MoS2 Edge Sites Using Dispersion-Corrected DFT Free Energy Calculations"	2018-11-30	Dataset
Supplementary Data for "Identifying Promising Metal−Organic Frameworks for Heterogeneous Catalysis via High-Throughput Periodic Density Functional Theory"	2018-10-23	Dataset
Computation-Ready, Experimental Metal–Organic Frameworks	2014-10-04	Dataset
Investigation of particle damping mechanism via particle dynamics simulations	2013-07-10	Paper
Recent developments in the molecular modeling of diffusion in nanoporous materials	2007-05-29	Paper

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