Large-Scale spin-orbit coupled GW-Bethe-Salpeter equation calculations in AMS

L-Edge X-Ray spectrum NEXAFS (video and new tutorial)

Reductive Coupling of Nitric Oxide by Cu(I)

XPS: Predicting core Ionization Potentials with ADF (video tip of the week, new tutorial)

Electronic structure and magneto-structural correlation study of Cu2UL

Effects of relativity on superheavy dimers

Spin Orbit Coupling in Charge Transfer States

Density Functional Theory Study on the Catalytic Dehydrogenation of Methane on MoO3 (010) Surface

Benchmark Study on the Calculation of 119Sn NMR Chemical Shifts

Fast Intrinsic Emission Quenching in Cs4PbBr6 Nanocrystals