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Publications by Thom H. Dunning

Gaussian Basis Sets for Use in Correlated Molecular Calculations. V. Core‐valence Basis Sets for Boron Through Neon

Journal of Chemical Physics

Theoretical Chemistry

English

Computational Thermochemistry and Benchmarking of Reliable Methods

English

Related publications

Relativistic Segmented Contraction Basis Sets With Core-Valence Correlation Effects for Atoms 57La Through 71Lu: Sapporo-Dk-nZP Sets (N = D, T, Q)

Theoretical Chemistry Accounts

Theoretical Chemistry

English

Semiclassical Basis Sets for the Computation of Molecular Vibrational States

Journal of Chemical Physics

Theoretical Chemistry

English

Efficient Calculation of Integrals in Mixed Ramp-Gaussian Basis Sets

Journal of Chemical Physics

Theoretical Chemistry

English

Multipole Electrostatic Model for MNDO-like Techniques With Minimal Valence SPD-Basis Sets

Theoretical Chemistry Accounts

Theoretical Chemistry

English

Different Result Between Gaussian and GAMESon Same Named Basis Sets

Journal of Computer Chemistry, Japan

English

Erratum: “Periodic Boundary Conditions for QM/MM Calculations: Ewald Summation for Extended Gaussian Basis Sets” [J. Chem. Phys. 139, 244108 (2013)]

Journal of Chemical Physics

Theoretical Chemistry

English

Systematically Convergent Basis Sets for Transition Metals. I. All-Electron Correlation Consistent Basis Sets for the 3d Elements Sc–Zn

Journal of Chemical Physics

Theoretical Chemistry

English

Spin-Free Relativistic No-Pair Ab Initio Core Model Potentials and Valence Basis Sets for the Transition Metal Elements Sc to Hg. II

Journal of Chemical Physics

Theoretical Chemistry

English

Existence of Strictly Diabatic Basis Sets for the Two-State Problem

International Journal of Quantum Chemistry

Condensed Matter Physics

Molecular Physics,

Theoretical Chemistry

English