Merge branch 'main' of https://github.com/PGelss/wave_train

.github/workflows/publish-to-testpypi.yml

@@ -0,0 +1,41 @@
+# This workflow will upload a Python Package using Twine when a release is created
+# For more information see: https://docs.github.com/en/actions/automating-builds-and-tests/building-and-testing-python#publishing-to-package-registries
+
+# This workflow uses actions that are not certified by GitHub.
+# They are provided by a third-party and are governed by
+# separate terms of service, privacy policy, and support
+# documentation.
+
+name: Publish to TestPyPI repository
+
+on:
+  push:
+    branches: 
+      - 'main'
+
+permissions:
+  contents: read
+
+jobs:
+  deploy:
+
+    runs-on: ubuntu-latest
+
+    steps:
+    - uses: actions/checkout@v3
+    - name: Set up Python
+      uses: actions/setup-python@v3
+      with:
+        python-version: '3.x'
+    - name: Install dependencies
+      run: |
+        python -m pip install --upgrade pip
+        pip install build
+    - name: Build package
+      run: python -m build
+    - name: Publish package
+      uses: pypa/gh-action-pypi-publish@release/v1
+      with:
+        user: __token__
+        password: ${{ secrets.TEST_PYPI_API_TOKEN }}
+        repository_url: https://test.pypi.org/legacy/

.github/workflows/pypi-publish.yml

@@ -0,0 +1,39 @@
+# This workflow will upload a Python Package using Twine when a release is created
+# For more information see: https://docs.github.com/en/actions/automating-builds-and-tests/building-and-testing-python#publishing-to-package-registries
+
+# This workflow uses actions that are not certified by GitHub.
+# They are provided by a third-party and are governed by
+# separate terms of service, privacy policy, and support
+# documentation.
+
+name: Upload Python Package
+
+on:
+  release:
+    types: [created, published]
+
+permissions:
+  contents: read
+
+jobs:
+  deploy:
+
+    runs-on: ubuntu-latest
+
+    steps:
+    - uses: actions/checkout@v3
+    - name: Set up Python
+      uses: actions/setup-python@v3
+      with:
+        python-version: '3.x'
+    - name: Install dependencies
+      run: |
+        python -m pip install --upgrade pip
+        pip install build
+    - name: Build package
+      run: python -m build
+    - name: Publish package
+      uses: pypa/gh-action-pypi-publish@27b31702a0e7fc50959f5ad993c78deac1bdfc29
+      with:
+        user: __token__
+        password: ${{ secrets.PYPI_API_TOKEN }}

setup.cfg

@@ -1,17 +1,18 @@
 [metadata]
 name = wave_train 
-version = 0.1
+version = 1.0.0
 author =  Jerome Riedel, Patrick Gelß, Burkhard Schmidt
 author_email = burkhard.schmidt@fu-berlin.de
 description = Numerical quantum mechanics of chain-like systems based on tensor trains
 license = GNU v3.0
+long_description = file: README.md
+long_description_content_type = text/markdown
 
 [options]
 packages = find:
 python_requires = >=3.7, <4
 install_requires =
     matplotlib>=3.4.3
     numpy>=1.21.2
-    scikit_tt @ git+https://github.com/PGelss/scikit_tt.git
     scipy>=1.7.1
-    sympy>=1.9
+    sympy>=1.9