A one-step script to convert GTH pseudopotential to ".upf" format using CP2K's ATOM module. Numerical orbitals in ".orb" format for ABACUS can also generated by calling gaussian_orbital_for_ABACUS.

At a glance Expert's Rating Pros ・Tiny and portable ・Incredibly focused writing ・Easy-to-read screen Cons ・Far too expensive ...

Young Thug Apologizes to GloRilla: “I’m Sorry To You” The Atlanta rapper’s leaked phone conversation from jail went viral after he insulted Glo’s looks. news ...

A comprehensive AWS Glue Custom Connector that enables bidirectional data transfer between AWS Glue and SQL Server databases. This connector provides robust features including automatic schema ...