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The Journal of Physical Chemistry. A
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May 1, 2019
Molecular Dynamics Simulations on Relaxed Reduced-Dimensional Potential Energy Surfaces
Chang Liu, C T Kelley, Elena Jakubikova
Journal of Chemical Theory and Computation
|
November 21, 2015
Reaction Path Following with Sparse Interpolation
James Nance, Elena Jakubikova, C T Kelley
Journal of Chemical Theory and Computation
|
February 24, 2009
Solutions of the Optimized Closure Integral Equation Theory: Heteronuclear Polyatomic Fluids
M Marucho, C T Kelley, B Montgomery Pettitt
The Journal of Physical Chemistry. B
|
October 22, 2019
Approximating Periodic Potential Energy Surfaces with Sparse Trigonometric Interpolation
Zachary Morrow, Chang Liu, C T Kelley, et al.
The Journal of Chemical Physics
|
December 6, 2006
Spatially distributed stochastic systems: Equation-free and equation-assisted preconditioned computations
Liang Qiao, Radek Erban, C T Kelley, et al.
The Journal of Physical Chemistry. A
|
November 3, 2021
Interpolation Methods for Molecular Potential Energy Surface Construction
Hyuk-Yong Kwon, Zachary Morrow, C T Kelley, et al.
Journal of Chemical Theory and Computation
|
August 5, 2021
Efficient Approximation of Potential Energy Surfaces with Mixed-Basis Interpolation
Zachary Morrow, Hyuk-Yong Kwon, C T Kelley, et al.
Physical Chemistry Chemical Physics : PCCP
|
September 15, 2021
Reduced-dimensional surface hopping with offline-online computations
Zachary Morrow, Hyuk-Yong Kwon, C T Kelley, et al.
Inorganic Chemistry
|
November 17, 2015
Insights into the Spin-State Transitions in [Fe(tpy)2]2+: Importance of the Terpyridine Rocking Motion
James Nance, David N Bowman, Sriparna Mukherjee, et al.
Mathematical Biosciences and Engineering : MBE
|
March 19, 2009
Estimation and identification of parameters in a lumped cerebrovascular model
Scott R Pope, Laura M Ellwein, Cheryl L Zapata, et al.
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of 2
Search research articles
Search
Showing results (1-10 of 12) with videos related to
Sort By:
Page
of 2
The Journal of Physical Chemistry. A
|
May 1, 2019
Molecular Dynamics Simulations on Relaxed Reduced-Dimensional Potential Energy Surfaces
Chang Liu, C T Kelley, Elena Jakubikova
Journal of Chemical Theory and Computation
|
November 21, 2015
Reaction Path Following with Sparse Interpolation
James Nance, Elena Jakubikova, C T Kelley
Journal of Chemical Theory and Computation
|
February 24, 2009
Solutions of the Optimized Closure Integral Equation Theory: Heteronuclear Polyatomic Fluids
M Marucho, C T Kelley, B Montgomery Pettitt
The Journal of Physical Chemistry. B
|
October 22, 2019
Approximating Periodic Potential Energy Surfaces with Sparse Trigonometric Interpolation
Zachary Morrow, Chang Liu, C T Kelley, et al.
The Journal of Chemical Physics
|
December 6, 2006
Spatially distributed stochastic systems: Equation-free and equation-assisted preconditioned computations
Liang Qiao, Radek Erban, C T Kelley, et al.
The Journal of Physical Chemistry. A
|
November 3, 2021
Interpolation Methods for Molecular Potential Energy Surface Construction
Hyuk-Yong Kwon, Zachary Morrow, C T Kelley, et al.
Journal of Chemical Theory and Computation
|
August 5, 2021
Efficient Approximation of Potential Energy Surfaces with Mixed-Basis Interpolation
Zachary Morrow, Hyuk-Yong Kwon, C T Kelley, et al.
Physical Chemistry Chemical Physics : PCCP
|
September 15, 2021
Reduced-dimensional surface hopping with offline-online computations
Zachary Morrow, Hyuk-Yong Kwon, C T Kelley, et al.
Inorganic Chemistry
|
November 17, 2015
Insights into the Spin-State Transitions in [Fe(tpy)2]2+: Importance of the Terpyridine Rocking Motion
James Nance, David N Bowman, Sriparna Mukherjee, et al.
Mathematical Biosciences and Engineering : MBE
|
March 19, 2009
Estimation and identification of parameters in a lumped cerebrovascular model
Scott R Pope, Laura M Ellwein, Cheryl L Zapata, et al.
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of 2