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Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
November 21, 2020
Using collocation to study the vibrational dynamics of molecules
Tucker Carrington
The Journal of Chemical Physics
|
April 8, 2017
Perspective: Computing (ro-)vibrational spectra of molecules with more than four atoms
Tucker Carrington
The Journal of Chemical Physics
|
February 10, 2011
Using nonproduct quadrature grids to solve the vibrational Schrödinger equation in 12D
Gustavo Avila, Tucker Carrington
The Journal of Chemical Physics
|
December 18, 2016
Using an internal coordinate Gaussian basis and a space-fixed Cartesian coordinate kinetic energy operator to compute a vibrational spectrum with rectangular collocation
Sergei Manzhos, Tucker Carrington
The Journal of Chemical Physics
|
October 27, 2016
Using an expanding nondirect product harmonic basis with an iterative eigensolver to compute vibrational energy levels with as many as seven atoms
James Brown, Tucker Carrington
The Journal of Chemical Physics
|
November 30, 2006
Using neural networks to represent potential surfaces as sums of products
Sergei Manzhos, Tucker Carrington
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
January 8, 2013
Vibrational energy levels of difluorodioxirane computed with variational and perturbative methods from a hybrid force field
Raghunathan Ramakrishnan, Tucker Carrington
The Journal of Chemical Physics
|
April 15, 2023
Computing vibrational spectra using a new collocation method with a pruned basis and more points than basis functions: Avoiding quadrature
Jesse Simmons, Tucker Carrington
Chemical Reviews
|
October 6, 2020
Neural Network Potential Energy Surfaces for Small Molecules and Reactions
Sergei Manzhos, Tucker Carrington
The Journal of Chemical Physics
|
December 10, 2015
A multi-dimensional Smolyak collocation method in curvilinear coordinates for computing vibrational spectra
Gustavo Avila, Tucker Carrington
Page
of 10
Search research articles
Search
Showing results (1-10 of 100) with videos related to
Sort By:
Page
of 10
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
November 21, 2020
Using collocation to study the vibrational dynamics of molecules
Tucker Carrington
The Journal of Chemical Physics
|
April 8, 2017
Perspective: Computing (ro-)vibrational spectra of molecules with more than four atoms
Tucker Carrington
The Journal of Chemical Physics
|
February 10, 2011
Using nonproduct quadrature grids to solve the vibrational Schrödinger equation in 12D
Gustavo Avila, Tucker Carrington
The Journal of Chemical Physics
|
December 18, 2016
Using an internal coordinate Gaussian basis and a space-fixed Cartesian coordinate kinetic energy operator to compute a vibrational spectrum with rectangular collocation
Sergei Manzhos, Tucker Carrington
The Journal of Chemical Physics
|
October 27, 2016
Using an expanding nondirect product harmonic basis with an iterative eigensolver to compute vibrational energy levels with as many as seven atoms
James Brown, Tucker Carrington
The Journal of Chemical Physics
|
November 30, 2006
Using neural networks to represent potential surfaces as sums of products
Sergei Manzhos, Tucker Carrington
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy
|
January 8, 2013
Vibrational energy levels of difluorodioxirane computed with variational and perturbative methods from a hybrid force field
Raghunathan Ramakrishnan, Tucker Carrington
The Journal of Chemical Physics
|
April 15, 2023
Computing vibrational spectra using a new collocation method with a pruned basis and more points than basis functions: Avoiding quadrature
Jesse Simmons, Tucker Carrington
Chemical Reviews
|
October 6, 2020
Neural Network Potential Energy Surfaces for Small Molecules and Reactions
Sergei Manzhos, Tucker Carrington
The Journal of Chemical Physics
|
December 10, 2015
A multi-dimensional Smolyak collocation method in curvilinear coordinates for computing vibrational spectra
Gustavo Avila, Tucker Carrington
Page
of 10