Search

4 results in Authors: Tu Nguyen Thien Phuc

A Neural Network Potential with Rigorous Treatment of Long-Range Dispersion

Tu Nguyen Thien Phuc, Nazanin Rezajooei, Erin Johnson, Christopher Rowley

Version 2 posted 29 December 2022

857

Downloads

Organic Chemistry

Controlling Reactivity and Selectivity in the Mizoroki-Heck Reaction: High Throughput Evaluation of 1,5-Diaza-3,7-diphosphacyclooctane Ligands

Eric Isbrandt, Devon Chapple, Nguyen Thien Phuc Tu, Victoria Dimakos, Anne Marie Beardall, Paul Boyle, Christopher Rowley, Johanna Blacquiere, Stephen Newman

Version 1 posted 22 December 2023

785

Downloads

Theoretical and Computational Chemistry

Modeling Intermolecular Interactions With XDM Dispersion Corrections to Neural Network Potentials

Nguyen Thien Phuc Tu, Siri Williamson, Erin Johnson, Christopher Rowley

Version 1 posted 07 May 2024

179

Downloads

Theoretical and Computational Chemistry

Benchmarking Force Field and the ANI Neural Network Potentials for the Torsional Potential Energy Surface of Biaryl Drug Fragments

Shae-Lynn Lahey, Từ Nguyễn Thiên Phúc, Christopher Rowley

Version 2 posted 02 November 2020

937

Downloads