diff --git a/.ci_support/environment-mpich.yml b/.ci_support/environment-mpich.yml
index 0225e6c..c0a7824 100644
--- a/.ci_support/environment-mpich.yml
+++ b/.ci_support/environment-mpich.yml
@@ -5,7 +5,7 @@ dependencies:
 - lammps =2024.08.29=*_mpi_mpich_*
 - mpich =4.2.3
 - numpy =1.26.4
-- mpi4py =4.0.1
+- mpi4py =4.1.0
 - executorlib =1.5.1
 - ase =3.25.0
 - scipy =1.15.2
diff --git a/.ci_support/environment-openmpi.yml b/.ci_support/environment-openmpi.yml
index 812a6ee..bc652b5 100644
--- a/.ci_support/environment-openmpi.yml
+++ b/.ci_support/environment-openmpi.yml
@@ -5,7 +5,7 @@ dependencies:
 - lammps =2024.08.29=*_mpi_openmpi_*
 - openmpi =5.0.5
 - numpy =1.26.4
-- mpi4py =4.0.1
+- mpi4py =4.1.0
 - executorlib =1.5.1
 - ase =3.25.0
 - scipy =1.15.2
diff --git a/binder/environment.yml b/binder/environment.yml
index e7f943b..1c09756 100644
--- a/binder/environment.yml
+++ b/binder/environment.yml
@@ -4,7 +4,7 @@ dependencies:
 - openmpi
 - numpy =1.26.4
 - lammps =2024.08.29
-- mpi4py =4.0.1
+- mpi4py =4.1.0
 - executorlib =0.0.4
 - ase =3.25.0
 - scipy =1.15.2
diff --git a/pyproject.toml b/pyproject.toml
index 523d40c..874584f 100644
--- a/pyproject.toml
+++ b/pyproject.toml
@@ -24,7 +24,7 @@ classifiers = [
     "Programming Language :: Python :: 3.12",
 ]
 dependencies = [
-    "mpi4py==4.0.1",
+    "mpi4py==4.1.0",
     "executorlib==1.5.1",
     "numpy==1.26.4",
 ]