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Robbie T Ireland

Showing results (1-10 of 5) with videos related to

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The Journal of Chemical Physics|August 8, 2023
On the specialization of Gaussian basis sets for core-dependent propertiesRobbie T Ireland, Laura K McKemmish
Journal of Chemical Theory and Computation|November 4, 2025
Fully-Optimized Parameters for Mixed Ramp-Gaussian Basis SetsRobbie T Ireland, Samuel J Pitman, Laura K McKemmish
ACS Physical Chemistry Au|January 31, 2022
Lower Bounds for Nonrelativistic Atomic EnergiesRobbie T Ireland, Peter Jeszenszki, Edit Mátyus, et al.
The Journal of Physical Chemistry. A|August 29, 2024
Reply to Comment on "Benchmarking Basis Sets for Density Functional Theory Thermochemistry Calculations: Why Unpolarized Basis Sets and the Polarized 6-311G Family Should Be Avoided"Samuel J Pitman, Alicia K Evans, Robbie T Ireland, et al.
The Journal of Physical Chemistry. A|November 20, 2023
Benchmarking Basis Sets for Density Functional Theory Thermochemistry Calculations: Why Unpolarized Basis Sets and the Polarized 6-311G Family Should Be AvoidedSamuel J Pitman, Alicia K Evans, Robbie T Ireland, et al.
Pageof 1

Showing results (1-10 of 5) with videos related to

Sort By:
Pageof 1
The Journal of Chemical Physics|August 8, 2023
On the specialization of Gaussian basis sets for core-dependent propertiesRobbie T Ireland, Laura K McKemmish
Journal of Chemical Theory and Computation|November 4, 2025
Fully-Optimized Parameters for Mixed Ramp-Gaussian Basis SetsRobbie T Ireland, Samuel J Pitman, Laura K McKemmish
ACS Physical Chemistry Au|January 31, 2022
Lower Bounds for Nonrelativistic Atomic EnergiesRobbie T Ireland, Peter Jeszenszki, Edit Mátyus, et al.
The Journal of Physical Chemistry. A|August 29, 2024
Reply to Comment on "Benchmarking Basis Sets for Density Functional Theory Thermochemistry Calculations: Why Unpolarized Basis Sets and the Polarized 6-311G Family Should Be Avoided"Samuel J Pitman, Alicia K Evans, Robbie T Ireland, et al.
The Journal of Physical Chemistry. A|November 20, 2023
Benchmarking Basis Sets for Density Functional Theory Thermochemistry Calculations: Why Unpolarized Basis Sets and the Polarized 6-311G Family Should Be AvoidedSamuel J Pitman, Alicia K Evans, Robbie T Ireland, et al.
Pageof 1