Merge branch 'dev-minor' into dev-patch

.github/workflows/auto-tagger.yml

@@ -1,7 +1,6 @@
 name: Automatically create v[x] / latest tags
 
 on:
-  workflow_dispatch:
   release:
     types: [published, edited]
 
@@ -10,7 +9,5 @@ jobs:
     runs-on: ubuntu-latest
     steps:
       - uses: Actions-R-Us/actions-tagger@v2
-        env:
-          GITHUB_TOKEN: "${{secrets.GITHUB_TOKEN}}"
         with:
           publish_latest_tag: true

.github/workflows/cmake.yml

@@ -2,9 +2,9 @@ name: CMake
 
 on:
   push:
-    branches: [ "main" , "develop" ]
+    branches: [ "main" , "dev-minor" , "dev-patch" ]
   pull_request:
-    branches: [ "main" , "develop" ]
+    branches: [ "main" , "dev-minor" , "dev-patch" ]
 
 env:
   BUILD_TYPE: Release

CHANGELOG.md

@@ -4,8 +4,8 @@ All notable changes to this project will be documented in this file.
 
 The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.0.0/).
 The functionality is contained in a binary compiled from a source code.
-* [Input file format](doc/input-file.md) adheres to [Semantic Versioning](https://semver.org/spec/v2.0.0.html).
-* [Command line options](doc/operation-modes.md) do not strictly follow semantic versioning, although breaking changes
+* [Input file format](docs/input-file.md) adheres to [Semantic Versioning](https://semver.org/spec/v2.0.0.html).
+* [Command line options](docs/operation-modes.md) do not strictly follow semantic versioning, although breaking changes
   are not introduced unless necessary.
 * The source code API will not be versioned semantically until the software is also distributed as a static-linked C++
 library (later, with Python bindings as well).
@@ -14,6 +14,39 @@ library (later, with Python bindings as well).
 ## [Unreleased]
 
 
+## [1.2.0] - 2023-12-03
+
+### Fixed
+
+* Corrected [RAMSNAP](docs/output-formats.md#class-ramsnap) format documentation.
+* Using `--continue` on a finished run without averaging phases no longer throws `PreconditionException`
+  ([#68](https://github.com/PKua007/rampack/issues/68)).
+* Improved numerical stability of [class `optimize_cell`](docs/initial-arrangement.md#class-optimize_cell).
+  Before the fix, the minimal distance may have been determined incorrectly in selected cases.
+
+### Changed
+
+* Internal error reports now show a relative path of source location instead of an absolute one.
+* Documentation directory `doc/` renamed to `docs/` (needed for GitHub to recognize
+  [contributing.md](docs/contributing.md)).
+* *Distance* definition is now generalized to *distance vector* in [binning types](docs/observables.md#binning-types).
+* [Shape functions](docs/observables.md#shape-functions) can now be multivalued.
+* [Class `axis`](docs/observables.md#class-axis) shape function can now also output all three components of the axis.
+
+### Added
+
+* Added global/local switch for [class `bond_order`](docs/observables.md#class-bond_order).
+* Added [class `s220`](docs/observables.md#class-s220) and [class `s221`](docs/observables.md#class-s221) correlation functions.
+* Added [class `linear`](docs/observables.md#class-linear) binning type.
+* Added [class `q_tensor`](docs/observables.md#class-q_tensor) shape function.
+* Added [class `bin_averaged_function`](docs/observables.md#class-bin_averaged_function) bulk observable.
+* Added `print_count` switch to [class `pair_density_correlation`](#class-pair_density_correlation), [class `pair_averaged_correlation`](#class-pair_averaged_correlation),
+  [class `density_histogram`](#class-density_histogram), [class `probability_evolution`](#class-probability_evolution) and
+  [class `bin_averaged_function`](#class-bin_averaged_function) observables.
+* Added `normalization` arguments to [class `density_histogram`](#class-density_histogram).
+* Added the [source code walkthrough](docs/source-code.md) document.
+
+
 ## [1.1.0] - 2023-06-21
 
 ### Fixed
@@ -25,7 +58,7 @@ library (later, with Python bindings as well).
 
 * Added [v1] and [latest] tags.
 * Added MinGW support.
-* Added `randomize_rotation` lattice transformer.
+* Added [class `randomize_rotation`](docs/initial-arrangement.md#class-randomize_rotation) lattice transformer.
 
 
 ## [1.0.0] - 2023-06-18
@@ -37,10 +70,11 @@ This is the initial stable release of the simulation software.
 
 During the development stage (0.x versions) no changelog was maintained. The changes can be inferred from git history.
 
-[Unreleased]: https://github.com/PKua007/rampack/compare/latest..develop
+[Unreleased]: https://github.com/PKua007/rampack/compare/latest..dev-minor
 [latest]: https://github.com/PKua007/rampack/releases/tag/latest
 [v1]: https://github.com/PKua007/rampack/releases/tag/v1
-[1.1.0]: https://github.com/PKua007/rampack/releases/tag/v1.0.0
+[1.2.0]: https://github.com/PKua007/rampack/releases/tag/v1.2.0
+[1.1.0]: https://github.com/PKua007/rampack/releases/tag/v1.1.0
 [1.0.0]: https://github.com/PKua007/rampack/releases/tag/v1.0.0
 
 

CMakeLists.txt

@@ -10,6 +10,8 @@ add_compile_definitions(RAMPACK_VERSION_MAJOR=${PROJECT_VERSION_MAJOR}
                         RAMPACK_VERSION_MINOR=${PROJECT_VERSION_MINOR}
                         RAMPACK_VERSION_PATCH=${PROJECT_VERSION_PATCH})
 
+add_compile_definitions("RAMPACK_ROOT_DIR=\"${PROJECT_SOURCE_DIR}\"")
+
 # Check compiler support
 if (CMAKE_CXX_COMPILER_ID STREQUAL "GNU")
     if (NOT CMAKE_CXX_COMPILER_VERSION VERSION_GREATER_EQUAL 7.0)