Tucker Carrington

Publication Activity (10 Years)

Years Active: 2018-2024
Publications (10 Years): 23

Top Topics

Molecular Dynamics Simulations

Raman Spectroscopy

Energy Transfer

Top Venues

The Journal of chemical physics

Physical chemistry chemical physics : PCCP

The journal of physical chemistry. A

Chemical reviews

This page only lists publications with an associated author ORCID identifier.

Publications

Xiao-Gang Wang, Tucker Carrington
A two-step quadrature-based variational calculation of ro-vibrational levels and wavefunctions of CO 2 using a bisector- x molecule-fixed frame. Physical chemistry chemical physics : PCCP 26 (21) (2024)
Xiao-Gang Wang, Tucker Carrington
A two-step quadrature-based variational calculation of ro-vibrational levels and wavefunctions of CO 2 using a bisector- x molecule-fixed frame. Physical chemistry chemical physics : PCCP 26 (21) (2024)
Xiao-Gang Wang, Tucker Carrington
A two-step quadrature-based variational calculation of ro-vibrational levels and wavefunctions of CO 2 using a bisector- x molecule-fixed frame. Physical chemistry chemical physics : PCCP (2024)
Sergei Manzhos, Manabu Ihara, Tucker Carrington
Using Collocation to Solve the Schrödinger Equation. Journal of chemical theory and computation 19 (6) (2023)
Jesse Simmons, Tucker Carrington
Computing vibrational spectra using a new collocation method with a pruned basis and more points than basis functions: Avoiding quadrature. The Journal of chemical physics 158 (14) (2023)
Xiao-Gang Wang, Tucker Carrington
Computing excited OH stretch states of water dimer in 12D using contracted intermolecular and intramolecular basis functions. The Journal of chemical physics 158 (8) (2023)
Sangeeth Das Kallullathil, Tucker Carrington
Computing vibrational energy levels using a canonical polyadic tensor method with a fixed rank and a contraction tree. The Journal of chemical physics 158 (21) (2023)
Sergei Manzhos, Tucker Carrington
Neural Network Potential Energy Surfaces for Small Molecules and Reactions. Chemical reviews 121 (16) (2020)
Jonas Ku, Aditya Kamath, Tucker Carrington, Sergei Manzhos
Machine Learning Optimization of the Collocation Point Set for Solving the Kohn-Sham Equation. The journal of physical chemistry. A 123 (49) (2019)
Jesse Simmons, Xiao-Gang Wang, Tucker Carrington
Computational Study of the Rovibrational Spectra of CH2D+ and CHD2. The journal of physical chemistry. A 123 (47) (2019)
Sergei Manzhos, Tucker Carrington
Using rectangular collocation with finite difference derivatives to solve electronic Schrödinger equation. The Journal of chemical physics 149 (20) (2018)
Robert Wodraszka, Tucker Carrington
Systematically expanding nondirect product bases within the pruned multi-configuration time-dependent Hartree (MCTDH) method: A comparison with multi-layer MCTDH. The Journal of chemical physics 146 (19) (2018)
Xiao-Gang Wang, Tucker Carrington
Using monomer vibrational wavefunctions to compute numerically exact (12D) rovibrational levels of water dimer. The Journal of chemical physics 148 (7) (2018)
Tucker Carrington
Perspective: Computing (ro-)vibrational spectra of molecules with more than four atoms. The Journal of chemical physics 146 (12) (2018)
Aditya Kamath, Rodrigo A Vargas-Hernández, Roman V Krems, Tucker Carrington, Sergei Manzhos
Neural networks vs Gaussian process regression for representing potential energy surfaces: A comparative study of fit quality and vibrational spectrum accuracy. The Journal of chemical physics 148 (24) (2018)
Phillip S Thomas, Tucker Carrington
An intertwined method for making low-rank, sum-of-product basis functions that makes it possible to compute vibrational spectra of molecules with more than 10 atoms. The Journal of chemical physics 146 (20) (2018)
Phillip S Thomas, Tucker Carrington, Jay Agarwal, Henry F Schaefer
Using an iterative eigensolver and intertwined rank reduction to compute vibrational spectra of molecules with more than a dozen atoms: Uracil and naphthalene. The Journal of chemical physics 149 (6) (2018)
Xiao-Gang Wang, Tucker Carrington
Using monomer vibrational wavefunctions as contracted basis functions to compute rovibrational levels of an H2O-atom complex in full dimensionality. The Journal of chemical physics 146 (10) (2018)
Zhiqiang Zhao, Jun Chen, Zhaojun Zhang, Dong H Zhang, Xiao-Gang Wang, Tucker Carrington, Fabien Gatti
Computing energy levels of CH4, CHD3, CH3D, and CH3F with a direct product basis and coordinates based on the methyl subsystem. The Journal of chemical physics 148 (7) (2018)
Robert Wodraszka, Tucker Carrington
A new collocation-based multi-configuration time-dependent Hartree (MCTDH) approach for solving the Schrödinger equation with a general potential energy surface. The Journal of chemical physics 148 (4) (2018)
Pushp Bajaj, Xiao-Gang Wang, Tucker Carrington, Francesco Paesani
Vibrational spectra of halide-water dimers: Insights on ion hydration from full-dimensional quantum calculations on many-body potential energy surfaces. The Journal of chemical physics 148 (10) (2018)
Gustavo Avila, Tucker Carrington
Reducing the cost of using collocation to compute vibrational energy levels: Results for CH2NH. The Journal of chemical physics 147 (6) (2018)
Gustavo Avila, Tucker Carrington
Computing vibrational energy levels of CH4 with a Smolyak collocation method. The Journal of chemical physics 147 (14) (2018)