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Update to version 0.3.0 #34

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Aug 29, 2024
Merged

Update to version 0.3.0 #34

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2 changes: 1 addition & 1 deletion CMakeLists.txt
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Original file line number Diff line number Diff line change
Expand Up @@ -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"
)

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2 changes: 1 addition & 1 deletion config/cmake/Findcustom-blas.cmake
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Expand Up @@ -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}")
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4 changes: 2 additions & 2 deletions config/cmake/Findcustom-lapack.cmake
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Expand Up @@ -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")
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2 changes: 1 addition & 1 deletion config/cmake/Findmctc-lib.cmake
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Expand Up @@ -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")
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5 changes: 3 additions & 2 deletions fpm.toml
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@@ -1,5 +1,5 @@
name = "multicharge"
version = "0.2.0"
version = "0.3.0"
license = "Apache-2.0"
author = ["Sebastian Ehlert"]
maintainer = ["@awvwgk"]
Expand All @@ -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"
2 changes: 1 addition & 1 deletion meson.build
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Expand Up @@ -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: [
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4 changes: 2 additions & 2 deletions src/multicharge/version.f90
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Expand Up @@ -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
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2 changes: 1 addition & 1 deletion subprojects/mctc-lib.wrap
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@@ -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
2 changes: 1 addition & 1 deletion subprojects/mstore.wrap
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@@ -1,4 +1,4 @@
[wrap-git]
directory = mstore
url = https://github.com/grimme-lab/mstore
revision = v0.2.0
revision = v0.3.0
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