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Commit 3fd07cde authored by Massimo Riello's avatar Massimo Riello
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update

export CASTEP_COMMAND=/Users/maxoriello/CASTEP-16.1/obj/darwin_x86_64_gfortran4.9/castep.serial
parent 93075bd1
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......@@ -102,6 +102,17 @@
"superNames": [
"settings_barostat"
]
}, {
"description": "Reference to the atom type of each interaction atoms",
"dtypeStr": "r",
"name": "interaction_atoms_to_atom_type_ref",
"referencedSections": [
"section_atom_type"
],
"shape": [],
"superNames": [
"settings_interaction"
]
}
]
......
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