Data from: Hartree–Fock implementation using a Laguerre-based wave function for the ground state and correlation energies of two-electron atoms

King AW, Baskerville AL, Cox H

Date Published: February 10, 2018

DOI: https://doi.org/10.5061/dryad.fr34t

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Title A Maple script containing all the HF wavefunctions
Downloaded 8 times
Description A Maple file containing 20-term Laguerre-based HF wavefunctions for the helium iso-electronic sequence, Z = 1 to 18, and for the Z_critical systems (ZC_FC and ZC_HF, see main paper for details)
Download HF_wavefunctions_final.mw (49.43 Kb)
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When using this data, please cite the original publication:

King AW, Baskerville AL, Cox H (2018) Hartree–Fock implementation using a Laguerre-based wave function for the ground state and correlation energies of two-electron atoms. Philosophical Transactions of the Royal Society A 376(2115): 20170153. https://doi.org/10.1098/rsta.2017.0153

Additionally, please cite the Dryad data package:

King AW, Baskerville AL, Cox H (2018) Data from: Hartree–Fock implementation using a Laguerre-based wave function for the ground state and correlation energies of two-electron atoms. Dryad Digital Repository. https://doi.org/10.5061/dryad.fr34t
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