Dataset for "A new generation of effective core potentials from correlated and spin-orbit calculations: selected heavy elements"

Wang, Guangming; Kincaid, Benjamin; Zhou, Haihan; Annaberdiyev, Abdulgani; Bennett, M. Chandler; Krogel, Jaron T.; Mitas, Lubos

ccECPs spin-orbit heavy elements QMC

Organizations

MDF Open

Year

2022

Source Name

spinorbit_ccecp

License

CC-BY 4.0

Contacts

Guangming Wang

DOI

10.18126/imhe-8csm View on Datacite

Get the Data

Dataset for "A new generation of effective core potentials from correlated and spin-orbit calculations: selected heavy elements". Data is categorized by each element.