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Expand file tree Collapse file tree Original file line number Diff line number Diff line change @@ -12,7 +12,7 @@ The SSCHA code comes as a python library, with computationally intense part spee
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15- conda create -n sscha -c conda-forge python=3.10 gfortran=11 libblas lapack openmpi julia openmpi-mpicc pip=23 numpy=1.26 scipy=1.10 spglib=2.2 setuptools=64
15+ conda create -n sscha -c conda-forge python=3.12 gfortran=11 libblas lapack openmpi julia openmpi-mpicc pip=23 numpy=1.26 scipy=1.10 spglib=2.2 setuptools=64
1616conda activate sscha
1717pip install ase julia mpi4py
1818pip install cellconstructor python-sscha tdscha
@@ -89,7 +89,7 @@ First make sure you have anaconda installed [(install anaconda)](https://www.ana
8989The following commands are sufficient to install the full sscha suite and its dependencies.
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9191```
92- conda create -n sscha -c conda-forge python=3.10 gfortran=11 libblas lapack openmpi julia openmpi-mpicc pip=23 numpy=1.26 scipy=1.10 spglib=2.2 setuptools=64
92+ conda create -n sscha -c conda-forge python=3.12 gfortran=11 libblas lapack openmpi julia openmpi-mpicc pip=23 numpy=1.26 scipy=1.10 spglib=2.2 setuptools=64
9393conda activate sscha
9494pip install ase julia mpi4py
9595pip install cellconstructor python-sscha tdscha
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