Update to version 0.3.0 (#34)

grimme-lab · Aug 29, 2024 · 282626e · 282626e
1 parent f8b4141
commit 282626e
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Showing 9 changed files with 13 additions and 12 deletions.
diff --git a/CMakeLists.txt b/CMakeLists.txt
@@ -19,7 +19,7 @@ get_directory_property(is-subproject PARENT_DIRECTORY)
 project(
   "multicharge"
   LANGUAGES "Fortran"
-  VERSION "0.2.0"
+  VERSION "0.3.0"
   DESCRIPTION "Molecular structure store for testing"
 )
 

diff --git a/config/cmake/Findcustom-blas.cmake b/config/cmake/Findcustom-blas.cmake
@@ -22,7 +22,7 @@ if(WITH_ILP64)
 endif()
 
 if(NOT BLAS_FOUND)
-  find_package("BLAS")
+  find_package("BLAS" REQUIRED)
   if(NOT TARGET "BLAS::BLAS")
     add_library("BLAS::BLAS" INTERFACE IMPORTED)
     target_link_libraries("BLAS::BLAS" INTERFACE "${BLAS_LIBRARIES}")

diff --git a/config/cmake/Findcustom-lapack.cmake b/config/cmake/Findcustom-lapack.cmake
@@ -22,10 +22,10 @@ if(WITH_ILP64)
 endif()
 
 if(NOT LAPACK_FOUND)
-  find_package("LAPACK")
+  find_package("LAPACK" REQUIRED)
 
   if(NOT TARGET "BLAS::BLAS")
-    find_package("custom-blas")
+    find_package("custom-blas" REQUIRED)
   endif()
 
   if(NOT TARGET "LAPACK::LAPACK")

diff --git a/config/cmake/Findmctc-lib.cmake b/config/cmake/Findmctc-lib.cmake
@@ -16,7 +16,7 @@
 set(_lib "mctc-lib")
 set(_pkg "MCTCLIB")
 set(_url "https://github.com/grimme-lab/mctc-lib")
-set(_rev "v0.3.0")
+set(_rev "v0.3.2")
 
 if(NOT DEFINED "${_pkg}_FIND_METHOD")
   if(DEFINED "${PROJECT_NAME}-dependency-method")

diff --git a/fpm.toml b/fpm.toml
@@ -1,5 +1,5 @@
 name = "multicharge"
-version = "0.2.0"
+version = "0.3.0"
 license = "Apache-2.0"
 author = ["Sebastian Ehlert"]
 maintainer = ["@awvwgk"]
@@ -10,7 +10,8 @@ link = ["lapack", "blas"]
 
 [dependencies]
 mctc-lib.git = "https://github.com/grimme-lab/mctc-lib.git"
-mctc-lib.tag = "v0.3.0"
+mctc-lib.tag = "v0.3.2"
 
 [dev-dependencies]
 mstore.git = "https://github.com/grimme-lab/mstore.git"
+mstore.tag = "v0.3.0"
diff --git a/meson.build b/meson.build
@@ -16,7 +16,7 @@
 project(
   'multicharge',
   'fortran',
-  version: '0.2.0',
+  version: '0.3.0',
   license: 'Apache-2.0',
   meson_version: '>=0.55',
   default_options: [

diff --git a/src/multicharge/version.f90 b/src/multicharge/version.f90
@@ -23,10 +23,10 @@ module multicharge_version
 
 
    !> String representation of the multicharge version
-   character(len=*), parameter :: multicharge_version_string = "0.2.0"
+   character(len=*), parameter :: multicharge_version_string = "0.3.0"
 
    !> Numeric representation of the multicharge version
-   integer, parameter :: multicharge_version_compact(3) = [0, 2, 0]
+   integer, parameter :: multicharge_version_compact(3) = [0, 3, 0]
 
 
 contains

diff --git a/subprojects/mctc-lib.wrap b/subprojects/mctc-lib.wrap
@@ -1,4 +1,4 @@
 [wrap-git]
 directory = mctc-lib
 url = https://github.com/grimme-lab/mctc-lib
-revision = v0.3.0
+revision = v0.3.2
diff --git a/subprojects/mstore.wrap b/subprojects/mstore.wrap
@@ -1,4 +1,4 @@
 [wrap-git]
 directory = mstore
 url = https://github.com/grimme-lab/mstore
-revision = v0.2.0
+revision = v0.3.0