From 4b60e22d785d01a823924fc45537154774f8ae61 Mon Sep 17 00:00:00 2001
From: "T.Tian" <alchem0x2a@gmail.com>
Date: Sat, 16 Nov 2024 19:37:31 +0800
Subject: [PATCH] update workflow

---
 .github/workflows/publish-pypi.yml | 5 +++++
 setup.py                           | 4 ++--
 2 files changed, 7 insertions(+), 2 deletions(-)

diff --git a/.github/workflows/publish-pypi.yml b/.github/workflows/publish-pypi.yml
index 7061b5a3..252eb65e 100644
--- a/.github/workflows/publish-pypi.yml
+++ b/.github/workflows/publish-pypi.yml
@@ -43,6 +43,11 @@ jobs:
       run: |
         # Wheels are inside dist/ folder
         python -m build
+        # Check the contents, if psp exists
+        TMP_DIR=$(mktemp -d)
+        unzip dist/sparc_x_api-*.whl -d ${TMP_DIR}
+        find $TMP_DIR/sparc/psp -name "*.psp8"
+
     - name: Publish package distributions to PyPI
       uses: pypa/gh-action-pypi-publish@release/v1
       with:
diff --git a/setup.py b/setup.py
index 5972ee77..f492c9d8 100644
--- a/setup.py
+++ b/setup.py
@@ -25,7 +25,7 @@
 
 setup(
     name="sparc-x-api",
-    version="1.0.4",
+    version="1.0.5",
     python_requires=">=3.8",
     description="Python API for the SPARC DFT Code",
     author="Tian Tian, Lucas R Timmerman, Ben Comer",
@@ -33,7 +33,7 @@
     url="https://github.com/SPARC-X/SPARC-X-API",
     packages=find_packages(),
     # ASE 3.22 dependency will be deprecated in 2.0+ release
-    install_requires=["ase>=3.23.0", "numpy>=1.23", "packaging>=20.0", "psutil>=5.0.0"],
+    install_requires=["ase>=3.22.0", "numpy>=1.23", "packaging>=20.0", "psutil>=5.0.0"],
     entry_points={
         # The ioformats are only compatible with ase>=3.23
         "ase.ioformats": [