#1118184 ITP: sirius-electronic-structure -- domain specific library for electronic structure calculations

#1118184#5
Date:
2025-10-16 07:04:44 UTC
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To:
* Package name    : sirius
   Version         : 6.4.2
   Upstream Author : Anton Kozhevnikov, Thomas Schulthess
* URL             : https://github.com/electronic-structure/SIRIUS
* License         : BSD-2-Clause
   Programming Lang: C++
   Description     : domain specific library for electronic structure
calculations

SIRIUS is a domain specific library for electronic structure
calculations. It implements plane wave pseudopotential (PW-PP) and full
potential linearized augmented plane wave (FP-LAPW) methods and designed
to work with popular community codes such as Exciting, Elk and Quantum
ESPRESSO. SIRIUS is written in C++11 with MPI, OpenMP and CUDA
programming models.

Remark: This package is to be maintained with Debichem Team at
https://salsa.debian.org/debichem-team/sirius