Jesse Mcdaniel

Jesse Mcdaniel

Georgia Institute of Technology - Atlanta / United States
Natural Sciences / Chemical Sciences
AD Scientific Index ID: 1414802
person_outline Jesse Mcdaniel's MOST POPULAR ARTICLES
1-) Physically-motivated force fields from symmetry-adapted perturbation theoryJG McDaniel, JR SchmidtThe Journal of Physical Chemistry A 117 (10), 2053-2066, 20131362013
2-) Ab Initio, Physically Motivated Force Fields for CO2 Adsorption in Zeolitic Imidazolate FrameworksJG McDaniel, K Yu, JR SchmidtThe Journal of Physical Chemistry C 116 (2), 1892-1903, 20121042012
3-) Evaluation of force field performance for high-throughput screening of gas uptake in metal–organic frameworksJG McDaniel, S Li, E Tylianakis, RQ Snurr, JR SchmidtThe Journal of Physical Chemistry C 119 (6), 3143-3152, 2015842015
4-) Next-generation force fields from symmetry-adapted perturbation theoryJG McDaniel, JR SchmidtAnnual Review of Physical Chemistry 67 (1), 467-488, 2016932016
5-) First-Principles United Atom Force Field for the Ionic Liquid BMIM+BF4–: An Alternative to Charge ScalingCY Son, JG McDaniel, JR Schmidt, Q Cui, A YethirajThe Journal of Physical Chemistry B 120 (14), 3560-3568, 2016922016