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Atsushi Togo 2018-11-02 13:59:00 +09:00
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doc/install.rst
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@ -107,11 +107,22 @@ OpenBLAS provided by conda (with multithread BLAS)
The installtion of LAPACKE is easy by conda. It is::
% conda install openblas
% conda install -c conda-forge openblas
or if the python libraries are not yet installed::
The recent change of openblas package provided from anaconda makes to
install nomkl, i.e., numpy and scipy with Intel MKL cannot be used
together with openblas. At this moment, this is avoided to install
openblas from conda-forge channel. If the python libraries are not yet
installed::
% conda install openblas numpy scipy h5py pyyaml matplotlib
% conda install numpy scipy h5py pyyaml matplotlib
% conda install -c conda-forge openblas
When using hdf5 files from NFS mouted location, the latest h5py may
not work. In this case, installation of an older version is
recommended::
% conda install hdf5=1.8.18
This openblas package contains BLAS, LAPACK, and LAPACKE. When this
``libopenblas`` is linked and the ``else`` statement of the C macro
@ -198,11 +209,11 @@ macOS. But it requires a basic knowledge on UNIX and python. So if
you are afraid of that, please prepare a computer or a virtual machine
with a normal linux OS such as Ubuntu-linux-64bit 14.04 or 16.04.
If you think you are familiar with macOS, unix system, and python,
the recommended installation process is written at
https://atztogo.github.io/phonopy/MacOSX.html, which is more-or-less
the same as phonopy, but with openblas, too. An example of the
procedure is summarized in the next section.
If you think you are familiar with macOS, unix system, and python, the
recommended installation process is written at
https://atztogo.github.io/phonopy/install.html#using-phonopy-on-mac-os-x,
which is more-or-less the same as phonopy, but with openblas, too. An
example of the procedure is summarized in the next section.
.. _install_an_example:
@ -233,6 +244,11 @@ An example of installation process
% wget https://repo.continuum.io/miniconda/Miniconda3-latest-MacOSX-x86_64.sh
Conda provided compiler (gcc for linux and clang for macOS) can be
also used instead of system provided compiler, brew, or
macport. The detail can be found at
https://conda.io/docs/user-guide/tasks/build-packages/compiler-tools.html.
2. Install conda packages
It is supposed to have the following environment variable::
@ -246,7 +262,14 @@ An example of installation process
The necessary python libraries and openBLAS are installed by::
% conda install numpy scipy h5py pyyaml matplotlib openblas
% conda install numpy scipy h5py pyyaml matplotlib
% conda install -c conda-forge openblas
When using hdf5 files from NFS mouted location, the latest h5py may
not work. In this case, installation of an older version is
recommended::
% conda install hdf5=1.8.18
Install the latest phonopy and phono3py::