don't set CMAKE_TUNE_FLAGS to anything by default
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@ -69,14 +69,6 @@ if(${CMAKE_CXX_COMPILER_ID} STREQUAL "Intel")
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endif()
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endif()
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if(${CMAKE_CXX_COMPILER_ID} STREQUAL "GNU")
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set(CMAKE_TUNE_DEFAULT "-march=native")
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endif()
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if(${CMAKE_CXX_COMPILER_ID} STREQUAL "Clang")
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set(CMAKE_TUNE_DEFAULT "-march=native")
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endif()
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# we require C++11 without extensions
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set(CMAKE_CXX_STANDARD 11)
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set(CMAKE_CXX_STANDARD_REQUIRED ON)
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@ -366,7 +358,7 @@ foreach(PKG_WITH_INCL KSPACE PYTHON VORONOI USER-COLVARS USER-MOLFILE USER-NETCD
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endif()
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endforeach()
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set(CMAKE_TUNE_FLAGS "${CMAKE_TUNE_DEFAULT}" CACHE STRING "Compiler specific optimization or instrumentation")
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set(CMAKE_TUNE_FLAGS "${CMAKE_TUNE_DEFAULT}" CACHE STRING "Compiler and machine specific optimization flags (compilation only)")
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separate_arguments(CMAKE_TUNE_FLAGS)
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foreach(_FLAG ${CMAKE_TUNE_FLAGS})
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target_compile_options(lammps PRIVATE ${_FLAG})
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@ -193,14 +193,17 @@ compiler and any :doc:`accelerator packages <Speed_packages>` you have
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included in the build.
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You can tell CMake to look for a specific compiler with setting CMake
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variable during configuration. For a few common choices, there are also
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presets in the ``cmake/presets`` folder. For convenience, there is a
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``CMAKE_TUNE_FLAGS`` variable that can be set to apply global compiler
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options. More on that below, but you can also specify the corresponding
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``CMAKE_*_FLAGS`` variables individually if you want to experiment with
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alternate optimization flags. You should specify all 3 compilers, so
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that the (few) LAMMPS source files written in C or Fortran are built
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with a compiler consistent with the one used for the C++ files:
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variables (listed below) during configuration. For a few common
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choices, there are also presets in the ``cmake/presets`` folder. For
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convenience, there is a ``CMAKE_TUNE_FLAGS`` variable that can be set to
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apply global compiler options (applied to compilation only), to be used
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for adding compiler or host specific optimization flags in addition to
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the "flags" variables listed below. You may also specify the
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corresponding ``CMAKE_*_FLAGS`` variables individually, if you want to
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experiment with alternate optimization flags. You should specify all 3
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compilers, so that the (few) LAMMPS source files written in C or Fortran
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are built with a compiler consistent with the one used for the C++
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files:
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.. code-block:: bash
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@ -229,11 +232,7 @@ can be loaded with `-C ../cmake/presets/clang.cmake`. Similarly,
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In addition you can set ``CMAKE_TUNE_FLAGS`` to specifically add
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compiler flags to tune for optimal performance on given hosts. By
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default these are initialized to some compiler specific flags, to
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optimize the LAMMPS executable with optimizations and instructions
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available on the host where LAMMPS is compiled. For example, for Intel
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compilers this would be ``-xHost`` and for GNU compilers this would be
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``-march=native``. To turn these flags off, do ``-D CMAKE_TUNE_FLAGS=``.
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default this variable is empty.
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.. note::
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@ -331,7 +331,7 @@ Some common LAMMPS specific variables
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* - ``BUILD_DOC``
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- include building the HTML format documentation for packaging/installing (default: ``off``)
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* - ``CMAKE_TUNE_FLAGS``
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- common compiler flags, for optimization or instrumentation (default: compiler specific)
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- common compiler flags, for optimization or instrumentation (default:)
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* - ``LAMMPS_MACHINE``
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- when set to ``name`` the LAMMPS executable and library will be called ``lmp_name`` and ``liblammps_name.a``
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* - ``LAMMPS_EXCEPTIONS``
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