ARTICLE
|
doi:10.20944/preprints202010.0442.v1
Subject:
Physical Sciences,
Atomic And Molecular Physics
Keywords:
relativistic multireference coupled cluster method; heavy element compounds; transition properties
Online: 21 October 2020 (14:24:58 CEST)
ARTICLE
|
doi:10.20944/preprints202212.0530.v1
Subject:
Physical Sciences,
Atomic And Molecular Physics
Keywords:
generalized relativistic pseudopotentials; molecular integrals; Gaussian basis functions; relativistic coupled cluster theory; excited states; heavy-element compounds; high-precision electronic structure modeling; thorium oxide; uranium dioxide.
Online: 28 December 2022 (07:57:51 CET)