From e84a524a9483544f3c1dff6a2777e279c1f8fadf Mon Sep 17 00:00:00 2001
From: "pre-commit-ci[bot]"
 <66853113+pre-commit-ci[bot]@users.noreply.github.com>
Date: Mon, 2 Sep 2024 20:50:49 +0000
Subject: [PATCH 01/18] [pre-commit.ci] pre-commit autoupdate
MIME-Version: 1.0
Content-Type: text/plain; charset=UTF-8
Content-Transfer-Encoding: 8bit

updates:
- [github.com/astral-sh/ruff-pre-commit: v0.6.2 → v0.6.3](https://github.com/astral-sh/ruff-pre-commit/compare/v0.6.2...v0.6.3)
---
 .pre-commit-config.yaml | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/.pre-commit-config.yaml b/.pre-commit-config.yaml
index ead5764..1d000a9 100644
--- a/.pre-commit-config.yaml
+++ b/.pre-commit-config.yaml
@@ -1,6 +1,6 @@
 repos:
   - repo: https://github.com/astral-sh/ruff-pre-commit
-    rev: v0.6.2
+    rev: v0.6.3
     hooks:
       - id: ruff
         name: ruff lint

From 8c27366e9166796da9abe9104d1804e979579f66 Mon Sep 17 00:00:00 2001
From: "pre-commit-ci[bot]"
 <66853113+pre-commit-ci[bot]@users.noreply.github.com>
Date: Mon, 9 Sep 2024 20:57:20 +0000
Subject: [PATCH 02/18] [pre-commit.ci] pre-commit autoupdate
MIME-Version: 1.0
Content-Type: text/plain; charset=UTF-8
Content-Transfer-Encoding: 8bit

updates:
- [github.com/astral-sh/ruff-pre-commit: v0.6.3 → v0.6.4](https://github.com/astral-sh/ruff-pre-commit/compare/v0.6.3...v0.6.4)
---
 .pre-commit-config.yaml | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/.pre-commit-config.yaml b/.pre-commit-config.yaml
index 1d000a9..98d5784 100644
--- a/.pre-commit-config.yaml
+++ b/.pre-commit-config.yaml
@@ -1,6 +1,6 @@
 repos:
   - repo: https://github.com/astral-sh/ruff-pre-commit
-    rev: v0.6.3
+    rev: v0.6.4
     hooks:
       - id: ruff
         name: ruff lint

From cac335180fa45ae4f0cc28d5a2cbda5360bd0661 Mon Sep 17 00:00:00 2001
From: "pre-commit-ci[bot]"
 <66853113+pre-commit-ci[bot]@users.noreply.github.com>
Date: Mon, 16 Sep 2024 20:54:50 +0000
Subject: [PATCH 03/18] [pre-commit.ci] pre-commit autoupdate
MIME-Version: 1.0
Content-Type: text/plain; charset=UTF-8
Content-Transfer-Encoding: 8bit

updates:
- [github.com/astral-sh/ruff-pre-commit: v0.6.4 → v0.6.5](https://github.com/astral-sh/ruff-pre-commit/compare/v0.6.4...v0.6.5)
---
 .pre-commit-config.yaml | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/.pre-commit-config.yaml b/.pre-commit-config.yaml
index 98d5784..23157dd 100644
--- a/.pre-commit-config.yaml
+++ b/.pre-commit-config.yaml
@@ -1,6 +1,6 @@
 repos:
   - repo: https://github.com/astral-sh/ruff-pre-commit
-    rev: v0.6.4
+    rev: v0.6.5
     hooks:
       - id: ruff
         name: ruff lint

From 4e4a56e633adc64cfbe60e3345529bc440615127 Mon Sep 17 00:00:00 2001
From: "pre-commit-ci[bot]"
 <66853113+pre-commit-ci[bot]@users.noreply.github.com>
Date: Mon, 23 Sep 2024 20:57:23 +0000
Subject: [PATCH 04/18] [pre-commit.ci] pre-commit autoupdate
MIME-Version: 1.0
Content-Type: text/plain; charset=UTF-8
Content-Transfer-Encoding: 8bit

updates:
- [github.com/astral-sh/ruff-pre-commit: v0.6.5 → v0.6.7](https://github.com/astral-sh/ruff-pre-commit/compare/v0.6.5...v0.6.7)
---
 .pre-commit-config.yaml | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/.pre-commit-config.yaml b/.pre-commit-config.yaml
index 23157dd..5a9400f 100644
--- a/.pre-commit-config.yaml
+++ b/.pre-commit-config.yaml
@@ -1,6 +1,6 @@
 repos:
   - repo: https://github.com/astral-sh/ruff-pre-commit
-    rev: v0.6.5
+    rev: v0.6.7
     hooks:
       - id: ruff
         name: ruff lint

From 52769675fceba88335a0b65b141ee4b71f136d7b Mon Sep 17 00:00:00 2001
From: "pre-commit-ci[bot]"
 <66853113+pre-commit-ci[bot]@users.noreply.github.com>
Date: Mon, 30 Sep 2024 21:10:53 +0000
Subject: [PATCH 05/18] [pre-commit.ci] pre-commit autoupdate
MIME-Version: 1.0
Content-Type: text/plain; charset=UTF-8
Content-Transfer-Encoding: 8bit

updates:
- [github.com/astral-sh/ruff-pre-commit: v0.6.7 → v0.6.8](https://github.com/astral-sh/ruff-pre-commit/compare/v0.6.7...v0.6.8)
---
 .pre-commit-config.yaml | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/.pre-commit-config.yaml b/.pre-commit-config.yaml
index 5a9400f..34c7408 100644
--- a/.pre-commit-config.yaml
+++ b/.pre-commit-config.yaml
@@ -1,6 +1,6 @@
 repos:
   - repo: https://github.com/astral-sh/ruff-pre-commit
-    rev: v0.6.7
+    rev: v0.6.8
     hooks:
       - id: ruff
         name: ruff lint

From fb6f1ad2287769bc6ba7a87bda5c37fa5d9a58c5 Mon Sep 17 00:00:00 2001
From: "dependabot[bot]" <49699333+dependabot[bot]@users.noreply.github.com>
Date: Wed, 2 Oct 2024 03:51:39 +0000
Subject: [PATCH 06/18] Bump executorlib from 0.0.2 to 0.0.3

Bumps [executorlib](https://github.com/pyiron/executorlib) from 0.0.2 to 0.0.3.
- [Release notes](https://github.com/pyiron/executorlib/releases)
- [Commits](https://github.com/pyiron/executorlib/compare/executorlib-0.0.2...executorlib-0.0.3)

---
updated-dependencies:
- dependency-name: executorlib
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <support@github.com>
---
 pyproject.toml | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/pyproject.toml b/pyproject.toml
index cc33f41..693d136 100644
--- a/pyproject.toml
+++ b/pyproject.toml
@@ -25,7 +25,7 @@ classifiers = [
 ]
 dependencies = [
     "mpi4py==4.0.0",
-    "executorlib==0.0.2",
+    "executorlib==0.0.3",
     "numpy==1.26.4",
 ]
 dynamic = ["version"]

From a72891d7abe7a6f0ad9174db7365da21ee28682a Mon Sep 17 00:00:00 2001
From: "github-actions[bot]"
 <41898282+github-actions[bot]@users.noreply.github.com>
Date: Wed, 2 Oct 2024 03:51:59 +0000
Subject: [PATCH 07/18] [dependabot skip] Update environment

---
 .ci_support/environment-mpich.yml   | 2 +-
 .ci_support/environment-openmpi.yml | 2 +-
 binder/environment.yml              | 2 +-
 3 files changed, 3 insertions(+), 3 deletions(-)

diff --git a/.ci_support/environment-mpich.yml b/.ci_support/environment-mpich.yml
index 8c6cb28..2875f21 100644
--- a/.ci_support/environment-mpich.yml
+++ b/.ci_support/environment-mpich.yml
@@ -6,6 +6,6 @@ dependencies:
 - mpich =4.2.2
 - numpy =1.26.4
 - mpi4py =4.0.0
-- executorlib =0.0.2
+- executorlib =0.0.3
 - ase =3.23.0
 - scipy =1.14.1
diff --git a/.ci_support/environment-openmpi.yml b/.ci_support/environment-openmpi.yml
index 1925c12..06b4885 100644
--- a/.ci_support/environment-openmpi.yml
+++ b/.ci_support/environment-openmpi.yml
@@ -6,6 +6,6 @@ dependencies:
 - openmpi =5.0.5
 - numpy =1.26.4
 - mpi4py =4.0.0
-- executorlib =0.0.2
+- executorlib =0.0.3
 - ase =3.23.0
 - scipy =1.14.1
diff --git a/binder/environment.yml b/binder/environment.yml
index c5896b5..64b7cf1 100644
--- a/binder/environment.yml
+++ b/binder/environment.yml
@@ -5,6 +5,6 @@ dependencies:
 - numpy =1.26.4
 - lammps =2024.06.27
 - mpi4py =4.0.0
-- executorlib =0.0.2
+- executorlib =0.0.3
 - ase =3.23.0
 - scipy =1.14.1

From 5ca148c5d3ac4d4083b119b9a7e8e8d0d76131e8 Mon Sep 17 00:00:00 2001
From: Jan Janssen <janssen@mpie.de>
Date: Wed, 2 Oct 2024 06:06:20 +0200
Subject: [PATCH 08/18] Switch to MPIExecSpawner

---
 pylammpsmpi/wrapper/concurrent.py | 4 ++--
 1 file changed, 2 insertions(+), 2 deletions(-)

diff --git a/pylammpsmpi/wrapper/concurrent.py b/pylammpsmpi/wrapper/concurrent.py
index 405ed81..08bb3ce 100644
--- a/pylammpsmpi/wrapper/concurrent.py
+++ b/pylammpsmpi/wrapper/concurrent.py
@@ -9,7 +9,7 @@
 from typing import Any, List, Optional
 
 from executorlib.shared import (
-    MpiExecInterface,
+    MpiExecSpawner,
     RaisingThread,
     cancel_items_in_queue,
     interface_bootup,
@@ -55,7 +55,7 @@ def execute_async(
         cmds.extend(cmdargs)
     interface = interface_bootup(
         command_lst=cmds,
-        connections=MpiExecInterface(
+        connections=MpiExecSpawner(
             cwd=cwd,
             cores=cores,
             oversubscribe=oversubscribe,

From 0d2d248fc874eb282b869d5d5ca268da22053016 Mon Sep 17 00:00:00 2001
From: Jan Janssen <janssen@mpie.de>
Date: Wed, 2 Oct 2024 06:06:59 +0200
Subject: [PATCH 09/18] update old environment

---
 .ci_support/environment-old.yml | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/.ci_support/environment-old.yml b/.ci_support/environment-old.yml
index f2f6145..11ab944 100644
--- a/.ci_support/environment-old.yml
+++ b/.ci_support/environment-old.yml
@@ -5,6 +5,6 @@ dependencies:
 - openmpi
 - numpy =1.23.5
 - mpi4py =3.1.4
-- executorlib =0.0.1
+- executorlib =0.0.3
 - ase =3.23.0
 - scipy =1.9.3

From 19034d32bc919d6d0d6cb09bad137259113e186e Mon Sep 17 00:00:00 2001
From: Jan Janssen <janssen@mpie.de>
Date: Wed, 2 Oct 2024 06:21:54 +0200
Subject: [PATCH 10/18] fix

---
 pylammpsmpi/wrapper/concurrent.py | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/pylammpsmpi/wrapper/concurrent.py b/pylammpsmpi/wrapper/concurrent.py
index 08bb3ce..7cecb2e 100644
--- a/pylammpsmpi/wrapper/concurrent.py
+++ b/pylammpsmpi/wrapper/concurrent.py
@@ -58,7 +58,7 @@ def execute_async(
         connections=MpiExecSpawner(
             cwd=cwd,
             cores=cores,
-            oversubscribe=oversubscribe,
+            openmpi_oversubscribe=oversubscribe,
         ),
     )
     while True:

From 363c581de52a31406c2636ef8d284ec0538daf65 Mon Sep 17 00:00:00 2001
From: "pre-commit-ci[bot]"
 <66853113+pre-commit-ci[bot]@users.noreply.github.com>
Date: Mon, 7 Oct 2024 22:16:16 +0000
Subject: [PATCH 11/18] [pre-commit.ci] pre-commit autoupdate
MIME-Version: 1.0
Content-Type: text/plain; charset=UTF-8
Content-Transfer-Encoding: 8bit

updates:
- [github.com/astral-sh/ruff-pre-commit: v0.6.8 → v0.6.9](https://github.com/astral-sh/ruff-pre-commit/compare/v0.6.8...v0.6.9)
---
 .pre-commit-config.yaml | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/.pre-commit-config.yaml b/.pre-commit-config.yaml
index 34c7408..697edb3 100644
--- a/.pre-commit-config.yaml
+++ b/.pre-commit-config.yaml
@@ -1,6 +1,6 @@
 repos:
   - repo: https://github.com/astral-sh/ruff-pre-commit
-    rev: v0.6.8
+    rev: v0.6.9
     hooks:
       - id: ruff
         name: ruff lint

From e9ffb245d9f3b1db3783a65af48efb593fcd581b Mon Sep 17 00:00:00 2001
From: Jan Janssen <jan-janssen@users.noreply.github.com>
Date: Mon, 14 Oct 2024 06:42:15 +0200
Subject: [PATCH 12/18] Update environment-mpich.yml

---
 .ci_support/environment-mpich.yml | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/.ci_support/environment-mpich.yml b/.ci_support/environment-mpich.yml
index 2875f21..7d1897b 100644
--- a/.ci_support/environment-mpich.yml
+++ b/.ci_support/environment-mpich.yml
@@ -3,7 +3,7 @@ channels:
 dependencies:
 - coverage
 - lammps =2024.06.27=*_mpi_mpich_*
-- mpich =4.2.2
+- mpich =4.2.3
 - numpy =1.26.4
 - mpi4py =4.0.0
 - executorlib =0.0.3

From 4eb18197a0aefe34d19fa5351f4e63769a5263e7 Mon Sep 17 00:00:00 2001
From: "dependabot[bot]" <49699333+dependabot[bot]@users.noreply.github.com>
Date: Mon, 14 Oct 2024 04:46:35 +0000
Subject: [PATCH 13/18] Bump mpi4py from 4.0.0 to 4.0.1

Bumps [mpi4py](https://github.com/mpi4py/mpi4py) from 4.0.0 to 4.0.1.
- [Release notes](https://github.com/mpi4py/mpi4py/releases)
- [Changelog](https://github.com/mpi4py/mpi4py/blob/master/CHANGES.rst)
- [Commits](https://github.com/mpi4py/mpi4py/compare/4.0.0...4.0.1)

---
updated-dependencies:
- dependency-name: mpi4py
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <support@github.com>
---
 pyproject.toml | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/pyproject.toml b/pyproject.toml
index 693d136..f1ffdd9 100644
--- a/pyproject.toml
+++ b/pyproject.toml
@@ -24,7 +24,7 @@ classifiers = [
     "Programming Language :: Python :: 3.12",
 ]
 dependencies = [
-    "mpi4py==4.0.0",
+    "mpi4py==4.0.1",
     "executorlib==0.0.3",
     "numpy==1.26.4",
 ]

From 0fa5a7c19047c2b940d95773ed5b94f72059a05d Mon Sep 17 00:00:00 2001
From: "github-actions[bot]"
 <41898282+github-actions[bot]@users.noreply.github.com>
Date: Mon, 14 Oct 2024 04:46:48 +0000
Subject: [PATCH 14/18] [dependabot skip] Update environment

---
 .ci_support/environment-mpich.yml   | 2 +-
 .ci_support/environment-openmpi.yml | 2 +-
 binder/environment.yml              | 2 +-
 3 files changed, 3 insertions(+), 3 deletions(-)

diff --git a/.ci_support/environment-mpich.yml b/.ci_support/environment-mpich.yml
index 7d1897b..b9d36a6 100644
--- a/.ci_support/environment-mpich.yml
+++ b/.ci_support/environment-mpich.yml
@@ -5,7 +5,7 @@ dependencies:
 - lammps =2024.06.27=*_mpi_mpich_*
 - mpich =4.2.3
 - numpy =1.26.4
-- mpi4py =4.0.0
+- mpi4py =4.0.1
 - executorlib =0.0.3
 - ase =3.23.0
 - scipy =1.14.1
diff --git a/.ci_support/environment-openmpi.yml b/.ci_support/environment-openmpi.yml
index 06b4885..abca03f 100644
--- a/.ci_support/environment-openmpi.yml
+++ b/.ci_support/environment-openmpi.yml
@@ -5,7 +5,7 @@ dependencies:
 - lammps =2024.06.27=*_mpi_openmpi_*
 - openmpi =5.0.5
 - numpy =1.26.4
-- mpi4py =4.0.0
+- mpi4py =4.0.1
 - executorlib =0.0.3
 - ase =3.23.0
 - scipy =1.14.1
diff --git a/binder/environment.yml b/binder/environment.yml
index 64b7cf1..262a7cd 100644
--- a/binder/environment.yml
+++ b/binder/environment.yml
@@ -4,7 +4,7 @@ dependencies:
 - openmpi
 - numpy =1.26.4
 - lammps =2024.06.27
-- mpi4py =4.0.0
+- mpi4py =4.0.1
 - executorlib =0.0.3
 - ase =3.23.0
 - scipy =1.14.1

From 4a53b92df028dd9536be480527d08efb97675407 Mon Sep 17 00:00:00 2001
From: "dependabot[bot]" <49699333+dependabot[bot]@users.noreply.github.com>
Date: Tue, 15 Oct 2024 03:17:59 +0000
Subject: [PATCH 15/18] Bump executorlib from 0.0.3 to 0.0.4

Bumps [executorlib](https://github.com/pyiron/executorlib) from 0.0.3 to 0.0.4.
- [Release notes](https://github.com/pyiron/executorlib/releases)
- [Commits](https://github.com/pyiron/executorlib/compare/executorlib-0.0.3...executorlib-0.0.4)

---
updated-dependencies:
- dependency-name: executorlib
  dependency-type: direct:production
  update-type: version-update:semver-patch
...

Signed-off-by: dependabot[bot] <support@github.com>
---
 pyproject.toml | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/pyproject.toml b/pyproject.toml
index f1ffdd9..5c4f6ba 100644
--- a/pyproject.toml
+++ b/pyproject.toml
@@ -25,7 +25,7 @@ classifiers = [
 ]
 dependencies = [
     "mpi4py==4.0.1",
-    "executorlib==0.0.3",
+    "executorlib==0.0.4",
     "numpy==1.26.4",
 ]
 dynamic = ["version"]

From e1b49f2d64348f6a796680553ce585f8b4e5c620 Mon Sep 17 00:00:00 2001
From: "github-actions[bot]"
 <41898282+github-actions[bot]@users.noreply.github.com>
Date: Tue, 15 Oct 2024 03:18:13 +0000
Subject: [PATCH 16/18] [dependabot skip] Update environment

---
 .ci_support/environment-mpich.yml   | 2 +-
 .ci_support/environment-openmpi.yml | 2 +-
 binder/environment.yml              | 2 +-
 3 files changed, 3 insertions(+), 3 deletions(-)

diff --git a/.ci_support/environment-mpich.yml b/.ci_support/environment-mpich.yml
index b9d36a6..e8c61cb 100644
--- a/.ci_support/environment-mpich.yml
+++ b/.ci_support/environment-mpich.yml
@@ -6,6 +6,6 @@ dependencies:
 - mpich =4.2.3
 - numpy =1.26.4
 - mpi4py =4.0.1
-- executorlib =0.0.3
+- executorlib =0.0.4
 - ase =3.23.0
 - scipy =1.14.1
diff --git a/.ci_support/environment-openmpi.yml b/.ci_support/environment-openmpi.yml
index abca03f..ef1990e 100644
--- a/.ci_support/environment-openmpi.yml
+++ b/.ci_support/environment-openmpi.yml
@@ -6,6 +6,6 @@ dependencies:
 - openmpi =5.0.5
 - numpy =1.26.4
 - mpi4py =4.0.1
-- executorlib =0.0.3
+- executorlib =0.0.4
 - ase =3.23.0
 - scipy =1.14.1
diff --git a/binder/environment.yml b/binder/environment.yml
index 262a7cd..ae1984c 100644
--- a/binder/environment.yml
+++ b/binder/environment.yml
@@ -5,6 +5,6 @@ dependencies:
 - numpy =1.26.4
 - lammps =2024.06.27
 - mpi4py =4.0.1
-- executorlib =0.0.3
+- executorlib =0.0.4
 - ase =3.23.0
 - scipy =1.14.1

From 1aa6a61ef188c958189c6ec48db5e23b434da609 Mon Sep 17 00:00:00 2001
From: "pre-commit-ci[bot]"
 <66853113+pre-commit-ci[bot]@users.noreply.github.com>
Date: Mon, 21 Oct 2024 21:14:28 +0000
Subject: [PATCH 17/18] [pre-commit.ci] pre-commit autoupdate
MIME-Version: 1.0
Content-Type: text/plain; charset=UTF-8
Content-Transfer-Encoding: 8bit

updates:
- [github.com/astral-sh/ruff-pre-commit: v0.6.9 → v0.7.0](https://github.com/astral-sh/ruff-pre-commit/compare/v0.6.9...v0.7.0)
---
 .pre-commit-config.yaml | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/.pre-commit-config.yaml b/.pre-commit-config.yaml
index 697edb3..d7bc337 100644
--- a/.pre-commit-config.yaml
+++ b/.pre-commit-config.yaml
@@ -1,6 +1,6 @@
 repos:
   - repo: https://github.com/astral-sh/ruff-pre-commit
-    rev: v0.6.9
+    rev: v0.7.0
     hooks:
       - id: ruff
         name: ruff lint

From 774f6932b810fc2a082391c9f16b569627656bf7 Mon Sep 17 00:00:00 2001
From: "pre-commit-ci[bot]"
 <66853113+pre-commit-ci[bot]@users.noreply.github.com>
Date: Mon, 28 Oct 2024 21:31:27 +0000
Subject: [PATCH 18/18] [pre-commit.ci] pre-commit autoupdate
MIME-Version: 1.0
Content-Type: text/plain; charset=UTF-8
Content-Transfer-Encoding: 8bit

updates:
- [github.com/astral-sh/ruff-pre-commit: v0.7.0 → v0.7.1](https://github.com/astral-sh/ruff-pre-commit/compare/v0.7.0...v0.7.1)
---
 .pre-commit-config.yaml | 2 +-
 1 file changed, 1 insertion(+), 1 deletion(-)

diff --git a/.pre-commit-config.yaml b/.pre-commit-config.yaml
index d7bc337..f8d8dbf 100644
--- a/.pre-commit-config.yaml
+++ b/.pre-commit-config.yaml
@@ -1,6 +1,6 @@
 repos:
   - repo: https://github.com/astral-sh/ruff-pre-commit
-    rev: v0.7.0
+    rev: v0.7.1
     hooks:
       - id: ruff
         name: ruff lint