|
DFT-FE 1.3.0-pre
Density Functional Theory With Finite-Elements
|
#include <iostream>#include <vector>#include <libxml/parser.h>#include <libxml/tree.h>#include <fstream>#include <sstream>#include <cstdlib>#include <algorithm>#include <iterator>#include <iomanip>#include <stdexcept>#include <cmath>Namespaces | |
| namespace | dftfe |
| namespace | dftfe::pseudoUtils |
Functions | |
| std::vector< double > | dftfe::pseudoUtils::XmlTagReaderMain (std::vector< std::string > tag_name, std::string file_path_in) |
| void | dftfe::pseudoUtils::XmlTagReaderAttr (std::vector< std::string > tag_name, std::string file_path_in, std::vector< std::string > *attr_type, std::vector< std::string > *attr_value) |
| dftfe::Int | dftfe::pseudoUtils::xmlNodeChildCount (std::vector< std::string > tag_name, std::string file_path_in) |
| void | dftfe::pseudoUtils::xmltoSummaryFile (std::string file_path_in, std::string file_path_out) |
| void | dftfe::pseudoUtils::xmltoProjectorFile (std::string file_path_in, std::string file_path_out) |
| void | dftfe::pseudoUtils::xmltoLocalPotential (std::string file_path_in, std::string file_path_out) |
| void | dftfe::pseudoUtils::xmltoDenomFile (std::string file_path_in, std::string file_path_out) |
| void | dftfe::pseudoUtils::xmltoCoreDensityFile (std::string file_path_in, std::string file_path_out) |
| void | dftfe::pseudoUtils::xmltoDensityFile (std::string file_path_in, std::string file_path_out) |
| void | dftfe::pseudoUtils::xmltoOrbitalFile (std::string file_path_in, std::string file_path_out) |
| dftfe::Int | dftfe::pseudoUtils::pseudoPotentialToDftfeParser (const std::string file_path_in, const std::string file_path_out, const dftfe::Int verbosity, dftfe::uInt &nlccFlag, dftfe::uInt &socFlag, dftfe::uInt &pawFlag) |