CD spectrum of a BINAS-substituted thiolated gold nanoparticle

Nonlinear (d)10 dicoordinated transition metal complexes

Relativistic DFT locates 13C NMR signal of dirhodium carbene

New personnel: EU-funded PhD students and post-doc, office manager

The SCM team has been extended by the addition of four EU-funded positions. Three PhD students will develop AIMD methods for ground and excited states and one post-doc will develop electronic transport methods for 2D nanoelectronics.

Job opening: Scientific Partner Manager

The job opening for a scientific partner manager has been filled. Consider applying for a H2020 Marie Curie fellowship if you want to work for SCM.
 

Job opening: Allround Scientific Software Developer

The job opening for an allround scientific software developer has been filled. Consider applying for a H2020 Marie Curie fellowship if you want to work for SCM. 

Fortissimo: GPU and cloud-based HPC

SCM and SARA will investigate GPU-acceleration (ADF, ReaxFF) cloud-based HPC solutions

Unraveling f-block bonding interactions: novel uranium complexes

Agostic Isomers: different colors and structures

Water adsorption and dissociation on titania surfaces with ReaxFF