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| Original file line number | Diff line number | Diff line change |
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| @@ -0,0 +1,7 @@ | ||
| cmake_minimum_required(VERSION 3.1) | ||
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| project(ALAMODE) | ||
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| add_subdirectory(alm) | ||
| add_subdirectory(anphon) | ||
| add_subdirectory(tools) |
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| Original file line number | Diff line number | Diff line change |
|---|---|---|
| @@ -0,0 +1,145 @@ | ||
| cmake_minimum_required(VERSION 3.1) | ||
| set(CMAKE_CXX_STANDARD 11) | ||
| set(CMAKE_CXX_STANDARD_REQUIRED True) | ||
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| set(CMAKE_MACOSX_RPATH 1) | ||
| set(CMAKE_CXX_FLAGS_RELEASE "-O2") | ||
| set(CMAKE_CXX_FLAGS_DEBUG "-g -Wall -O0 -D_DEBUG") | ||
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| project(alm) | ||
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| # Version numbers | ||
| file(READ ${PROJECT_SOURCE_DIR}/../include/version.h version_file) | ||
| string(REGEX MATCH "ALAMODE_VERSION = \"([0-9]+\\.[0-9]+\\.[0-9]+)\"" alm_version ${version_file}) | ||
| set(alm_version ${CMAKE_MATCH_1}) | ||
| MESSAGE("Setting up for ALM code (ALAMODE version: ${CMAKE_MATCH_1})") | ||
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| if (SPGLIB_ROOT) | ||
| include_directories("${SPGLIB_ROOT}/include") | ||
| set(spglib "-L${SPGLIB_ROOT}/lib -L${SPGLIB_ROOT}/lib64 -lsymspg") | ||
| else() | ||
| message("SPGLIB_ROOT is not given by -DSPGLIB_ROOT option. Just add -lsymspg.") | ||
| set(spglib "-lsymspg") | ||
| endif() | ||
| # | ||
| # Add openmp flag if available | ||
| # | ||
| find_package(OpenMP) | ||
| if (OPENMP_FOUND) | ||
| set (CMAKE_CXX_FLAGS "${CMAKE_CXX_FLAGS} ${OpenMP_CXX_FLAGS}") | ||
| endif() | ||
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| find_package(Boost) | ||
| if (Boost_FOUND) | ||
| include_directories(${Boost_INCLUDE_DIRS}) | ||
| else() | ||
| if (BOOST_INCLUDE) | ||
| include_directories(${BOOST_INCLUDE}) | ||
| else() | ||
| message(FATAL_ERROR "Boost was not found. | ||
| Please specify the location of boost include directories | ||
| via -DBOOST_INCLUDE option.") | ||
| endif() | ||
| endif() | ||
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||
| find_package(Eigen3) | ||
| if (Eigen3_FOUND) | ||
| include_directories(${EIGEN3_INCLUDE_DIR}) | ||
| else() | ||
| if (EIGEN3_INCLUDE) | ||
| include_directories(${EIGEN3_INCLUDE}) | ||
| else() | ||
| message(FATAL_ERROR "Eigen3 was not found. | ||
| Please specify the location of boost include directories | ||
| via -DEIGEN3_INCLUDE option.") | ||
| endif() | ||
| endif() | ||
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||
| if (WITH_HDF5_SUPPORT) | ||
| add_definitions(-D_HDF5) | ||
| find_package(HDF5 COMPONENTS CXX) | ||
| if (HDF5_FOUND) | ||
| include_directories(${HDF5_INCLUDE_DIRS}) | ||
| set(hdf5library ${HDF5_LIBRARIES}) | ||
| else() | ||
| if (HDF5_ROOT) | ||
| include_directories("${HDF5_ROOT}/include") | ||
| set(hdf5library "-L${HDF5_ROOT}/lib -lhdf5_cpp -lhdf5") | ||
| else() | ||
| message(FATAL_ERROR "HDF5 was not found. | ||
| Please specify the HDF5 install directory | ||
| via -DHDF5_ROOT option.") | ||
| endif() | ||
| endif() | ||
| endif() | ||
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| find_package(LAPACK REQUIRED) | ||
| include_directories(${Lapack_INCLUDE_DIRS}) | ||
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| # Source code | ||
| include_directories("${PROJECT_SOURCE_DIR}/../include") | ||
| set(SOURCES ${PROJECT_SOURCE_DIR}/alm.cpp | ||
| ${PROJECT_SOURCE_DIR}/cluster.cpp ${PROJECT_SOURCE_DIR}/constraint.cpp | ||
| ${PROJECT_SOURCE_DIR}/fcs.cpp | ||
| ${PROJECT_SOURCE_DIR}/files.cpp | ||
| ${PROJECT_SOURCE_DIR}/input_parser.cpp | ||
| ${PROJECT_SOURCE_DIR}/input_setter.cpp | ||
| ${PROJECT_SOURCE_DIR}/optimize.cpp | ||
| ${PROJECT_SOURCE_DIR}/patterndisp.cpp | ||
| ${PROJECT_SOURCE_DIR}/rref.cpp | ||
| ${PROJECT_SOURCE_DIR}/symmetry.cpp | ||
| ${PROJECT_SOURCE_DIR}/system.cpp | ||
| ${PROJECT_SOURCE_DIR}/timer.cpp | ||
| ${PROJECT_SOURCE_DIR}/writer.cpp) | ||
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| set(HEADERS ${PROJECT_SOURCE_DIR}/alm.h | ||
| ${PROJECT_SOURCE_DIR}/cluster.h | ||
| ${PROJECT_SOURCE_DIR}/constraint.h | ||
| ${PROJECT_SOURCE_DIR}/fcs.h | ||
| ${PROJECT_SOURCE_DIR}/files.h | ||
| ${PROJECT_SOURCE_DIR}/input_parser.h | ||
| ${PROJECT_SOURCE_DIR}/input_setter.h | ||
| ${PROJECT_SOURCE_DIR}/optimize.h | ||
| ${PROJECT_SOURCE_DIR}/patterndisp.h | ||
| ${PROJECT_SOURCE_DIR}/rref.h | ||
| ${PROJECT_SOURCE_DIR}/symmetry.h | ||
| ${PROJECT_SOURCE_DIR}/system.h | ||
| ${PROJECT_SOURCE_DIR}/timer.h | ||
| ${PROJECT_SOURCE_DIR}/writer.h) | ||
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| # # Trick to use gcc to compile *.cpp: This doesn't work because of boost | ||
| # SET_SOURCE_FILES_PROPERTIES(${SOURCES} PROPERTIES LANGUAGE C) | ||
| # set(CMAKE_C_COMPILER "gcc") | ||
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| # Executable | ||
| add_executable(alm ${PROJECT_SOURCE_DIR}/main.cpp | ||
| ${PROJECT_SOURCE_DIR}/alm_cui.cpp | ||
| ${SOURCES} ${HEADERS}) | ||
| target_link_libraries(alm ${Boost_LIBRARIES} ${LAPACK_LIBRARIES} ${spglib}) | ||
| if (WITH_HDF5_SUPPORT) | ||
| target_link_libraries(alm ${hdf5library}) | ||
| endif() | ||
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| if (BUILD_LIBRARIES) | ||
| set(serial "${alm_version}") | ||
| set(soserial "1") | ||
| # Shared library | ||
| add_library(almcxx SHARED ${SOURCES}) | ||
| target_link_libraries(almcxx ${Boost_LIBRARIES} ${LAPACK_LIBRARIES} ${spglib}) | ||
| if (WITH_HDF5_SUPPORT) | ||
| target_link_libraries(almcxx ${hdf5library}) | ||
| endif() | ||
| set_property(TARGET almcxx PROPERTY VERSION ${serial}) | ||
| set_property(TARGET almcxx PROPERTY SOVERSION ${soserial}) | ||
| install(TARGETS almcxx DESTINATION ${PROJECT_SOURCE_DIR}/lib) | ||
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| # Static link library | ||
| add_library(almcxx_static STATIC ${SOURCES}) | ||
| set_property(TARGET almcxx_static PROPERTY VERSION ${serial}) | ||
| set_property(TARGET almcxx_static PROPERTY SOVERSION ${soserial}) | ||
| set_property(TARGET almcxx_static PROPERTY OUTPUT_NAME almcxx) | ||
| install(TARGETS almcxx_static ARCHIVE DESTINATION ${PROJECT_SOURCE_DIR}/lib) | ||
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| # Header file | ||
| install(FILES ${PROJECT_SOURCE_DIR}/alm.h DESTINATION ${PROJECT_SOURCE_DIR}/include) | ||
| endif() |
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