Revised Basis Sets for the LANL Effective Core Potentials
Author:
Affiliation:
1. Theoretical Division, Los Alamos National Laboratory, MS B268, Los Alamos, New Mexico 87545
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/ct8000409
Reference14 articles.
1. Effective Core Potentials for DFT Calculations
2. Fully relativistic correlated benchmark results for uranyl and a critical look at relativistic effective core potentials for uranium
3. Density functional investigations of the properties and thermochemistry of UF6 and UF5 using valence-electron and all-electron approaches
4. Ab initio effective core potentials for molecular calculations. Potentials for K to Au including the outermost core orbitals
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