Showing results (1-10 of 226) with videos related to
Sort By:
Pageof 23
The Journal of Chemical Physics|November 17, 2019
A Schwarz inequality for complex basis function methods in non-Hermitian quantum chemistryTravis H Thompson, Christian Ochsenfeld, Thomas-C JagauThe Journal of Chemical Physics|February 3, 2019
Integral partition bounds for fast and effective screening of general one-, two-, and many-electron integralsTravis H Thompson, Christian OchsenfeldThe Journal of Chemical Physics|October 17, 2017
Distance-including rigorous upper bounds and tight estimates for two-electron integrals over long- and short-range operatorsTravis H Thompson, Christian OchsenfeldJournal of Chemical Theory and Computation|April 16, 2024
Efficient Exploitation of Numerical Quadrature with Distance-Dependent Integral Screening in Explicitly Correlated F12 Theory: Linear Scaling Evaluation of the Most Expensive RI-MP2-F12 TermLars Urban, Henryk Laqua, Travis H Thompson, et al.Journal of Chemical Theory and Computation|February 14, 2020
Highly Efficient, Linear-Scaling Seminumerical Exact-Exchange Method for Graphic Processing UnitsHenryk Laqua, Travis H Thompson, Jörg Kussmann, et al.Journal of Chemical Theory and Computation|March 2, 2026
Formulation of an Efficient O(M4)-Scaling Explicitly Correlated MP2-F12 Correction by Combining Numerical Quadrature with Density Fitting and CABS-RILars Urban, Henryk Laqua, Travis H Thompson, et al.The Journal of Chemical Physics|June 6, 2018
Coupled-cluster treatment of molecular strong-field ionizationThomas-C JagauThe Journal of Chemical Physics|January 15, 2018
Non-iterative triple excitations in equation-of-motion coupled-cluster theory for electron attachment with applications to bound and temporary anionsThomas-C JagauChemical Communications (Cambridge, England)|April 8, 2022
Theory of electronic resonances: fundamental aspects and recent advancesThomas-C JagauThe Journal of Chemical Physics|December 3, 2016
Investigating tunnel and above-barrier ionization using complex-scaled coupled-cluster theoryThomas-C JagauPageof 23