Articles with "multi configuration" as a keyword



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High-accuracy multi-configuration Dirac–Hartree–Fock calculations of the energy levels and transition properties of Ga-like to Br-like gadolinium ions

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Published in 2017 at "Atomic Data and Nuclear Data Tables"

DOI: 10.1016/j.adt.2017.11.001

Abstract: Abstract Theoretical calculations of Ga-like to Br-like gadolinium ions were performed by using the fully relativistic multi-configuration Dirac–Hartree–Fock (MCDHF) method. Extensive lists of excitation energies, wavelengths, line and oscillator strengths, and E1, M1, E2, M2,… read more here.

Keywords: dirac hartree; like like; multi configuration; gadolinium ions ... See more keywords
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Carbon phase adjustment by multi-configuration ligand in endohedral metallofullerene derivatives Gd@C82(morpholine)7 under high pressure

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Published in 2021 at "Nano Today"

DOI: 10.1016/j.nantod.2021.101079

Abstract: Abstract Metallofullerenes present an ideal research object for developing new carbon structures with improved properties under high pressure. In this study, high pressure investigation is realized on metallofullerene derivatives (Gd@C82(morpholine)7) by applying in situ synchrotron… read more here.

Keywords: multi configuration; high pressure; pressure; carbon ... See more keywords