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The Journal of Physical Chemistry. A|January 25, 2013
Physically-motivated force fields from symmetry-adapted perturbation theoryJesse G McDaniel, J R Schmidt
Annual Review of Physical Chemistry|April 13, 2016
Next-Generation Force Fields from Symmetry-Adapted Perturbation TheoryJesse G McDaniel, J R Schmidt
The Journal of Physical Chemistry. B|March 25, 2014
First-principles many-body force fields from the gas phase to liquid: a "universal" approachJesse G McDaniel, J R Schmidt
Accounts of Chemical Research|February 18, 2015
Transferable next-generation force fields from simple liquids to complex materialsJ R Schmidt, Kuang Yu, Jesse G McDaniel
The Journal of Chemical Physics|January 3, 2013
An efficient multi-scale lattice model approach to screening nano-porous adsorbentsKuang Yu, Jesse G McDaniel, J R Schmidt
The Journal of Physical Chemistry. B|July 9, 2011
Physically motivated, robust, ab initio force fields for CO2 and N2Kuang Yu, Jesse G McDaniel, J R Schmidt
The Journal of Physical Chemistry Letters|August 18, 2015
First-Principles, Physically Motivated Force Field for the Ionic Liquid [BMIM][BF4]Eunsong Choi, Jesse G McDaniel, J R Schmidt, et al.
The Journal of Physical Chemistry. B|February 23, 2016
First-Principles United Atom Force Field for the Ionic Liquid BMIM(+)BF4(-): An Alternative to Charge ScalingChang Yun Son, Jesse G McDaniel, J R Schmidt, et al.
The Journal of Physical Chemistry. B|December 23, 2015
Conformational and Dynamic Properties of Poly(ethylene oxide) in an Ionic Liquid: Development and Implementation of a First-Principles Force FieldJesse G McDaniel, Eunsong Choi, Chang-Yun Son, et al.
The Journal of Physical Chemistry. B|June 29, 2016
Ab Initio Force Fields for Imidazolium-Based Ionic LiquidsJesse G McDaniel, Eunsong Choi, Chang Yun Son, et al.
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