Zobrazeno 1 - 3
of 3
pro vyhledávání: '"Rogeli Grima Torres"'
Publikováno v:
Open Research Europe, Vol 4 (2024)
Ab initio electronic structure applications are among the most widely used in High-Performance Computing (HPC), and the eigenvalue problem is often their main computational bottleneck. This article presents our initial efforts in porting these codes
Externí odkaz:
https://doaj.org/article/6f6d1e0bba1a4f3bb106975dc132137f
Publikováno v:
Open Research Europe, Vol 4 (2024)
Ab initio electronic structure applications are among the most widely used in High-Performance Computing (HPC), and the eigenvalue problem is often their main computational bottleneck. This article presents our initial efforts in porting these codes
Externí odkaz:
https://doaj.org/article/db12896a45b1479cb634d57e14db1c51
Publikováno v:
Open Research Europe, Vol 4 (2024)
This article introduces a suite of mini-applications (mini-apps) designed to optimise computational kernels in ab initio electronic structure codes. The suite is developed from flagship applications participating in the NOMAD Center of Excellence, su
Externí odkaz:
https://doaj.org/article/dfc431585ffd4683ab2747e192bf003f