AFLOW
 
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xAIMSOUT Class Reference

#include <aflow.h>

Public Member Functions

 xAIMSOUT ()
 
 ~xAIMSOUT ()
 
 xAIMSOUT (const std::string &fileIN, bool=true)
 
 xAIMSOUT (const xAIMSOUT &b)
 
const xAIMSOUToperator= (const xAIMSOUT &b)
 
void clear ()
 
bool GetProperties (const std::stringstream &stringstreamIN, bool=true)
 
bool GetProperties (const std::string &stringIN, bool=true)
 
bool GetPropertiesFile (const std::string &fileIN, bool=true)
 
bool GetPropertiesFile (const std::string &fileIN, uint natoms_check, bool)
 
bool GetPropertiesUrlFile (const std::string &url, const std::string &file, bool=true)
 

Public Attributes

std::string content
 
std::vector< std::string > vcontent
 
std::string filename
 
std::vector< aurostd::xvector< double > > vforces
 
double natoms
 

Private Member Functions

void free ()
 
void copy (const xAIMSOUT &b)
 

Detailed Description

Definition at line 1391 of file aflow.h.

Constructor & Destructor Documentation

◆ xAIMSOUT() [1/3]

xAIMSOUT::xAIMSOUT ( )

◆ ~xAIMSOUT()

xAIMSOUT::~xAIMSOUT ( )

◆ xAIMSOUT() [2/3]

xAIMSOUT::xAIMSOUT ( const std::string & fileIN,
bool = true )

◆ xAIMSOUT() [3/3]

xAIMSOUT::xAIMSOUT ( const xAIMSOUT & b)

Member Function Documentation

◆ operator=()

const xAIMSOUT & xAIMSOUT::operator= ( const xAIMSOUT & b)

◆ clear()

void xAIMSOUT::clear ( )

◆ GetProperties() [1/2]

bool xAIMSOUT::GetProperties ( const std::stringstream & stringstreamIN,
bool = true )

◆ GetProperties() [2/2]

bool xAIMSOUT::GetProperties ( const std::string & stringIN,
bool = true )

◆ GetPropertiesFile() [1/2]

bool xAIMSOUT::GetPropertiesFile ( const std::string & fileIN,
bool = true )

◆ GetPropertiesFile() [2/2]

bool xAIMSOUT::GetPropertiesFile ( const std::string & fileIN,
uint natoms_check,
bool  )

◆ GetPropertiesUrlFile()

bool xAIMSOUT::GetPropertiesUrlFile ( const std::string & url,
const std::string & file,
bool = true )

◆ free()

void xAIMSOUT::free ( )
private

◆ copy()

void xAIMSOUT::copy ( const xAIMSOUT & b)
private

Member Data Documentation

◆ content

std::string xAIMSOUT::content

Definition at line 1400 of file aflow.h.

◆ vcontent

std::vector<std::string> xAIMSOUT::vcontent

Definition at line 1401 of file aflow.h.

◆ filename

std::string xAIMSOUT::filename

Definition at line 1402 of file aflow.h.

◆ vforces

std::vector<aurostd::xvector<double> > xAIMSOUT::vforces

Definition at line 1403 of file aflow.h.

◆ natoms

double xAIMSOUT::natoms

Definition at line 1404 of file aflow.h.


The documentation for this class was generated from the following file: