CP2K Open Source Molecular Dynamics

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gpu [2024/10/14 09:20] – oschuettgpu [2025/02/09 12:00] (current) – DBM OpenCL hpabst
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 ^ Library                                                    ^ Status                           ^ Accelerates       ^ Backends          ^ [[https://catalog.ngc.nvidia.com/orgs/hpc/containers/cp2k | NGC Container]] ^ ^ Library                                                    ^ Status                           ^ Accelerates       ^ Backends          ^ [[https://catalog.ngc.nvidia.com/orgs/hpc/containers/cp2k | NGC Container]] ^
 | [[https://github.com/cp2k/dbcsr|DBCSR]]                    | @green: **Ready**                | LS-SCF            | CUDA, HIP, OpenCL | Included  | | [[https://github.com/cp2k/dbcsr|DBCSR]]                    | @green: **Ready**                | LS-SCF            | CUDA, HIP, OpenCL | Included  |
-| [[https://github.com/cp2k/cp2k/tree/master/src/dbm|DBM]]   | @green: **Ready**                | GW and RI methods | CUDA, HIP         | -         |+| [[https://github.com/cp2k/cp2k/tree/master/src/dbm|DBM]]   | @green: **Ready**                | GW and RI methods | CUDA, HIP. OpenCL | -         |
 | [[https://github.com/cp2k/cp2k/tree/master/src/grid|grid]] | @green: **Ready**                | GPW               | CUDA, HIP         | Included  | | [[https://github.com/cp2k/cp2k/tree/master/src/grid|grid]] | @green: **Ready**                | GPW               | CUDA, HIP         | Included  |
 | [[https://github.com/cp2k/cp2k/tree/master/src/pw|pw]]     | @green: **Ready**                | SCCS              | CUDA, HIP         | Included  | | [[https://github.com/cp2k/cp2k/tree/master/src/pw|pw]]     | @green: **Ready**                | SCCS              | CUDA, HIP         | Included  |
gpu.txt · Last modified: 2025/02/09 12:00 by hpabst