The ANO-R Basis Set | Journal of Chemical Theory and Computation
arXiv:2001.04224v2 [physics.comp-ph] 4 Mar 2020
A comparison of finite basis set and finite difference Hartree—Fock calculations for the open shell (X2Σ+), species BeF, BO,
Basis Sets and Pseudopotentials - презентация онлайн
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Basis set (chemistry) - Wikiwand
Computation of Dipole Moments: A Recommendation on the Choice of the Basis Set and the Level of Theory | The Journal of Physical Chemistry A
The logarithms of the optimized exponents, j , from a (21s16p12d)... | Download Scientific Diagram
PDF) The well-tempered GTF basis sets and their applications in the SCF calculations on N2, CO, Na2, and P2
Ab initio calculation of molecular spin‐orbit coupling constants using a universal even‐tempered basis set of exponential fu
Straightforward and accurate automatic auxiliary basis set generation for molecular calculations with atomic orbital basis sets
Extrapolating DFT Toward the Complete Basis Set Limit: Lessons from the PBE Family of Functionals | Journal of Chemical Theory and Computation
The CISD Coulomb hole of Ne for some even-tempered basis sets. | Download Scientific Diagram
Basis Sets and Pseudopotentials - презентация онлайн
Basis set (chemistry) - Wikipedia
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Computation | Free Full-Text | Generation of Basis Sets for Accurate Molecular Calculations: Application to Helium Atom and Dimer
Basis Sets and Pseudopotentials - презентация онлайн
Integrals and Integral Derivatives
The CISD Coulomb hole of Ne for some even-tempered basis sets. | Download Scientific Diagram
quantum chemistry - The format and values provided by Basis Set Exchange - Matter Modeling Stack Exchange
Gaussian Basis Sets for Solid State Calculations | SpringerLink
The ANO-R Basis Set | Journal of Chemical Theory and Computation
PDF) On the optimization of Gaussian basis sets
Universal systematic sequences of even‐tempered basis functions in electronic structure studies of negative ions
Gaussian Basis Sets for Solid State Calculations | SpringerLink
