From 453ff0428f2b8be04efb57a6260575ea78621152 Mon Sep 17 00:00:00 2001 From: trz42 <12829274+trz42@users.noreply.github.com> Date: Fri, 22 May 2026 14:46:56 +0000 Subject: [PATCH] update overview of available software --- docs/available_software/detail/ELPA.md | 3 ++- docs/available_software/detail/IQ-TREE.md | 3 ++- docs/available_software/detail/LSD2.md | 1 + docs/available_software/detail/QuantumESPRESSO.md | 3 ++- docs/available_software/detail/libxc.md | 3 ++- mkdocs.yml | 2 +- 6 files changed, 10 insertions(+), 5 deletions(-) diff --git a/docs/available_software/detail/ELPA.md b/docs/available_software/detail/ELPA.md index 454298b0d6..401854dd9e 100644 --- a/docs/available_software/detail/ELPA.md +++ b/docs/available_software/detail/ELPA.md @@ -22,7 +22,7 @@ json_ld: ratingValue: 5 softwareRequirements: See https://www.eessi.io/docs/ for how to make EESSI available on your system - softwareVersion: '[''2023.05.001'', ''2022.05.001'']' + softwareVersion: '[''2025.06.002'', ''2023.05.001'', ''2022.05.001'']' url: https://elpa.mpcdf.mpg.de/ --- # ELPA @@ -37,5 +37,6 @@ Eigenvalue SoLvers for Petaflop-Applications. |ELPA version|Supported CPU targets|Supported GPU targets|EESSI version|Module| | --- | --- | --- | --- | --- | +|2025.06.002|`generic`: `aarch64`, `x86_64`
Arm: `a64fx`, `neoverse_n1`, `neoverse_v1`, `nvidia/grace`
AMD: `zen2`, `zen3`, `zen4`
Intel: `haswell`, `skylake_avx512`, `sapphirerapids`, `icelake`, `cascadelake`
|*(none)*|2025.06|`ELPA/2025.06.002-foss-2025b`| |2023.05.001|`generic`: `aarch64`, `x86_64`
Arm: `a64fx`, `neoverse_n1`, `neoverse_v1`, `nvidia/grace`
AMD: `zen2`, `zen3`, `zen4`
Intel: `haswell`, `skylake_avx512`, `sapphirerapids`, `icelake`, `cascadelake`
|*(none)*|2023.06|`ELPA/2023.05.001-foss-2023a`| |2022.05.001|`generic`: `aarch64`, `x86_64`
Arm: `a64fx`, `neoverse_n1`, `neoverse_v1`, `nvidia/grace`
AMD: `zen2`, `zen3`, `zen4`
Intel: `haswell`, `skylake_avx512`, `sapphirerapids`, `icelake`, `cascadelake`
|*(none)*|2023.06|`ELPA/2022.05.001-foss-2022b`| \ No newline at end of file diff --git a/docs/available_software/detail/IQ-TREE.md b/docs/available_software/detail/IQ-TREE.md index b6764e5e77..218b954308 100644 --- a/docs/available_software/detail/IQ-TREE.md +++ b/docs/available_software/detail/IQ-TREE.md @@ -22,7 +22,7 @@ json_ld: ratingValue: 5 softwareRequirements: See https://www.eessi.io/docs/ for how to make EESSI available on your system - softwareVersion: '[''2.3.5'']' + softwareVersion: '[''3.1.2'', ''2.3.5'']' url: http://www.iqtree.org/ --- # IQ-TREE @@ -37,4 +37,5 @@ Efficient phylogenomic software by maximum likelihood |IQ-TREE version|Supported CPU targets|Supported GPU targets|EESSI version|Module| | --- | --- | --- | --- | --- | +|3.1.2|`generic`: `aarch64`, `x86_64`
Arm: `a64fx`, `neoverse_n1`, `neoverse_v1`, `nvidia/grace`
AMD: `zen2`, `zen3`, `zen4`
Intel: `haswell`, `skylake_avx512`, `sapphirerapids`, `icelake`, `cascadelake`
|*(none)*|2025.06|`IQ-TREE/3.1.2-gompi-2025a`| |2.3.5|`generic`: `aarch64`, `x86_64`
Arm: `a64fx`, `neoverse_n1`, `neoverse_v1`, `nvidia/grace`
AMD: `zen2`, `zen3`, `zen4`
Intel: `haswell`, `skylake_avx512`, `sapphirerapids`, `icelake`, `cascadelake`
|*(none)*|2023.06|`IQ-TREE/2.3.5-gompi-2023a`| \ No newline at end of file diff --git a/docs/available_software/detail/LSD2.md b/docs/available_software/detail/LSD2.md index 1981884f62..6eff4a8099 100644 --- a/docs/available_software/detail/LSD2.md +++ b/docs/available_software/detail/LSD2.md @@ -37,4 +37,5 @@ Least-squares methods to estimate rates and dates from phylogenies |LSD2 version|Supported CPU targets|Supported GPU targets|EESSI version|Module| | --- | --- | --- | --- | --- | +|2.4.1|`generic`: `aarch64`, `x86_64`
Arm: `a64fx`, `neoverse_n1`, `neoverse_v1`, `nvidia/grace`
AMD: `zen2`, `zen3`, `zen4`
Intel: `haswell`, `skylake_avx512`, `sapphirerapids`, `icelake`, `cascadelake`
|*(none)*|2025.06|`LSD2/2.4.1-GCCcore-14.2.0`| |2.4.1|`generic`: `aarch64`, `x86_64`
Arm: `a64fx`, `neoverse_n1`, `neoverse_v1`, `nvidia/grace`
AMD: `zen2`, `zen3`, `zen4`
Intel: `haswell`, `skylake_avx512`, `sapphirerapids`, `icelake`, `cascadelake`
|*(none)*|2023.06|`LSD2/2.4.1-GCCcore-12.3.0`| \ No newline at end of file diff --git a/docs/available_software/detail/QuantumESPRESSO.md b/docs/available_software/detail/QuantumESPRESSO.md index 30d32db462..b4ef1f5285 100644 --- a/docs/available_software/detail/QuantumESPRESSO.md +++ b/docs/available_software/detail/QuantumESPRESSO.md @@ -30,7 +30,7 @@ json_ld: ratingValue: 5 softwareRequirements: See https://www.eessi.io/docs/ for how to make EESSI available on your system - softwareVersion: '[''7.3.1'', ''7.2'']' + softwareVersion: '[''7.5'', ''7.3.1'', ''7.2'']' url: https://www.quantum-espresso.org --- # QuantumESPRESSO @@ -49,5 +49,6 @@ It is based on density-functional theory, plane waves, and pseudopotentials |QuantumESPRESSO version|Supported CPU targets|Supported GPU targets|EESSI version|Module| | --- | --- | --- | --- | --- | +|7.5|`generic`: `aarch64`, `x86_64`
Arm: `a64fx`, `neoverse_n1`, `neoverse_v1`, `nvidia/grace`
AMD: `zen2`, `zen3`, `zen4`
Intel: `haswell`, `skylake_avx512`, `sapphirerapids`, `icelake`, `cascadelake`
|*(none)*|2025.06|`QuantumESPRESSO/7.5-foss-2025b`| |7.3.1|`generic`: `aarch64`, `x86_64`
Arm: `a64fx`, `neoverse_n1`, `neoverse_v1`, `nvidia/grace`
AMD: `zen2`, `zen3`, `zen4`
Intel: `haswell`, `skylake_avx512`, `sapphirerapids`, `icelake`, `cascadelake`
|*(none)*|2023.06|`QuantumESPRESSO/7.3.1-foss-2023a`| |7.2|`generic`: `aarch64`, `x86_64`
Arm: `a64fx`, `neoverse_n1`, `neoverse_v1`, `nvidia/grace`
AMD: `zen2`, `zen3`, `zen4`
Intel: `haswell`, `skylake_avx512`, `sapphirerapids`, `icelake`, `cascadelake`
|*(none)*|2023.06|`QuantumESPRESSO/7.2-foss-2022b`| \ No newline at end of file diff --git a/docs/available_software/detail/libxc.md b/docs/available_software/detail/libxc.md index a5eff407c7..99c43e302c 100644 --- a/docs/available_software/detail/libxc.md +++ b/docs/available_software/detail/libxc.md @@ -24,7 +24,7 @@ json_ld: ratingValue: 5 softwareRequirements: See https://www.eessi.io/docs/ for how to make EESSI available on your system - softwareVersion: '[''6.2.2'', ''6.1.0'']' + softwareVersion: '[''7.0.0'', ''6.2.2'', ''6.1.0'']' url: https://www.tddft.org/programs/libxc --- # libxc @@ -40,6 +40,7 @@ Libxc is a library of exchange-correlation functionals for density-functional th |libxc version|Supported CPU targets|Supported GPU targets|EESSI version|Module| | --- | --- | --- | --- | --- | +|7.0.0|`generic`: `aarch64`, `x86_64`
Arm: `a64fx`, `neoverse_n1`, `neoverse_v1`, `nvidia/grace`
AMD: `zen2`, `zen3`, `zen4`
Intel: `haswell`, `skylake_avx512`, `sapphirerapids`, `icelake`, `cascadelake`
|*(none)*|2025.06|`libxc/7.0.0-GCC-14.3.0`| |6.2.2|`generic`: `aarch64`, `x86_64`
Arm: `a64fx`, `neoverse_n1`, `neoverse_v1`, `nvidia/grace`
AMD: `zen2`, `zen3`, `zen4`
Intel: `haswell`, `skylake_avx512`, `sapphirerapids`, `icelake`, `cascadelake`
|*(none)*|2025.06|`libxc/6.2.2-GCC-13.3.0`| |6.2.2|`generic`: `aarch64`, `x86_64`
Arm: `a64fx`, `neoverse_n1`, `neoverse_v1`, `nvidia/grace`
AMD: `zen2`, `zen3`, `zen4`
Intel: `haswell`, `skylake_avx512`, `sapphirerapids`, `icelake`, `cascadelake`
|*(none)*|2023.06|`libxc/6.2.2-GCC-12.3.0`| |6.1.0|`generic`: `aarch64`, `x86_64`
Arm: `a64fx`, `neoverse_n1`, `neoverse_v1`, `nvidia/grace`
AMD: `zen2`, `zen3`, `zen4`
Intel: `haswell`, `skylake_avx512`, `sapphirerapids`, `icelake`, `cascadelake`
|*(none)*|2023.06|`libxc/6.1.0-GCC-12.2.0`| \ No newline at end of file diff --git a/mkdocs.yml b/mkdocs.yml index 9c9d1343b1..3504ec7b54 100644 --- a/mkdocs.yml +++ b/mkdocs.yml @@ -212,7 +212,7 @@ extra: - icon: fontawesome/brands/twitter link: https://twitter.com/eessi_hpc # this gets auto-updated via update_generated_time.sh script run in update_available_software.yml action - generated_time: "Thu, 21 May 2026 at 04:07:40 UTC" + generated_time: "Fri, 22 May 2026 at 14:46:54 UTC" slack_invite_url: "https://join.slack.com/t/eessi-hpc/shared_invite/zt-2wg10p26d-m_CnRB89xQq3zk9qxf1k3g" extra_javascript: # mermaid diagram