A comprehensive review of the thermodynamic properties of the oxide compounds of the
lanthanide and actinide elements is presented. The available literature data for the solid …

Actinides are the heaviest chemical elements with practical relevance. Among them, only
thorium and uranium can be found in nature in substantial quantities, while natural …

Gaussian (14s13p10d8f6g)/[6s6p5d4f3g] atomic natural orbital valence basis sets have
been generated for relativistic energy-consistent small-core actinide pseudopotentials of the …

Gaussian (14s13p10d8f6g)/[10s8p5d4f3g] valence basis sets using a segmented
contraction scheme have been derived for relativistic energy-consistent small-core …

Gaussian (14s13p10d8f6g)/[10s9p5d4f3g] valence basis sets using a segmented
contraction scheme have been derived for relativistic energy-consistent small-core actinide …

Einstein proposed his theory of special relativity in 1905. For a long time it was believed that
this theory has no significant impact on chemistry. This view changed in the 1970s when it …

Gaussian (14s13p10d8f6g)/[6s6p5d4f3g] atomic natural orbital valence basis sets have
been derived for relativistic energy-consistent small-core lanthanide pseudopotentials of the …

The development of transition metal intermetallic compounds, in which active sites are
incorporated in lattice frameworks, has great potential for modulating the local structure and …

In this review, lanthanide chelating tags and their applications to pseudocontact shift NMR
spectroscopy as well as analysis of residual dipolar couplings are covered. A complete …

The importance of spin–orbit effects on the predictions of energetic properties of actinide
compounds has been considered for 18 different density functionals, comparing the spin …