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The Journal of Chemical Physics|March 5, 2008
Interpolating moving least-squares methods for fitting potential energy surfaces: a strategy for efficient automatic data point placement in high dimensionsRichard Dawes, Donald L Thompson, Albert F Wagner, et al.
The Journal of Chemical Physics|May 19, 2007
Interpolating moving least-squares methods for fitting potential energy surfaces: computing high-density potential energy surface data from low-density ab initio data pointsRichard Dawes, Donald L Thompson, Yin Guo, et al.
The Journal of Chemical Physics|April 17, 2009
Interpolating moving least-squares methods for fitting potential energy surfaces: using classical trajectories to explore configuration spaceRichard Dawes, Alessio Passalacqua, Albert F Wagner, et al.
The Journal of Physical Chemistry. A|April 18, 2009
Ab initio wavenumber accurate spectroscopy: 1CH2 and HCN vibrational levels on automatically generated IMLS potential energy surfacesRichard Dawes, Albert F Wagner, Donald L Thompson
The Journal of Chemical Physics|September 7, 2013
A classical trajectory study of the intramolecular dynamics, isomerization, and unimolecular dissociation of HO2Jamin W Perry, Richard Dawes, Albert F Wagner, et al.
The Journal of Chemical Physics|July 23, 2004
Improving the accuracy of interpolated potential energy surfaces by using an analytical zeroth-order potential functionAkio Kawano, Yin Guo, Donald L Thompson, et al.
The Journal of Chemical Physics|December 11, 2007
Interpolating moving least-squares methods for fitting potential energy surfaces: Improving efficiency via local approximantsYin Guo, Igor Tokmakov, Donald L Thompson, et al.
The Journal of Chemical Physics|September 9, 2004
Interpolating moving least-squares methods for fitting potential energy surfaces: applications to classical dynamics calculationsYin Guo, Akio Kawano, Donald L Thompson, et al.
The Journal of Chemical Physics|November 20, 2004
Interpolating moving least-squares methods for fitting potential energy surfaces: Analysis of an application to a six-dimensional systemGia G Maisuradze, Akio Kawano, Donald L Thompson, et al.
The Journal of Chemical Physics|March 17, 2007
Interpolating moving least-squares methods for fitting potential energy surfaces: an application to the H2CN unimolecular reactionYin Guo, Lawrence B Harding, Albert F Wagner, et al.
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