CASM
AClustersApproachtoStatisticalMechanics
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#include "casm/app/AppIO.hh"
#include "casm/symmetry/SymInfo.hh"
#include "casm/basis_set/FunctionVisitor.hh"
#include "casm/clusterography/jsonClust.hh"
Go to the source code of this file.
Namespaces | |
CASM | |
Main CASM namespace. | |
Functions | |
BasicStructure< Site > | CASM::read_prim (fs::path filename) |
BasicStructure< Site > | CASM::read_prim (const jsonParser &json) |
Read prim.json. More... | |
void | CASM::write_prim (const BasicStructure< Site > &prim, fs::path filename, COORD_TYPE mode) |
Write prim.json to file. More... | |
void | CASM::write_prim (const BasicStructure< Site > &prim, jsonParser &json, COORD_TYPE mode) |
Write prim.json as JSON. More... | |
void | CASM::write_symop (const SymGroup &grp, Index i, jsonParser &j) |
void | CASM::write_symgroup (const SymGroup &grp, jsonParser &json) |
ChemicalReference | CASM::read_chemical_reference (fs::path filename, const Structure &prim, double tol) |
Read chemical reference states from JSON file. More... | |
ChemicalReference | CASM::read_chemical_reference (const jsonParser &json, const Structure &prim, double tol) |
Read chemical reference states from JSON. More... | |
void | CASM::write_chemical_reference (const ChemicalReference &chem_ref, fs::path filename) |
void | CASM::write_chemical_reference (const ChemicalReference &chem_ref, jsonParser &json) |
void | CASM::write_prim_nlist (const Array< UnitCellCoord > &prim_nlist, const fs::path &nlistpath) |
Array< UnitCellCoord > | CASM::read_prim_nlist (const fs::path &nlistpath) |
void | CASM::write_basis (const SiteOrbitree &tree, const Structure &prim, jsonParser &json, double tol) |
Write summary of basis functions. More... | |