#include <basisset.h>
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| void | Load (const std::string &name) |
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| const Element & | getElement (std::string element_type) const |
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| std::map< std::string, Element >::iterator | begin () |
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| std::map< std::string, Element >::iterator | end () |
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| std::map< std::string, Element >::const_iterator | begin () const |
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| std::map< std::string, Element >::const_iterator | end () const |
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| const std::string & | Name () const |
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Definition at line 134 of file basisset.h.
◆ addElement()
| Element & votca::xtp::BasisSet::addElement |
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std::string |
elementType | ) |
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private |
◆ begin() [1/2]
| std::map< std::string, Element >::iterator votca::xtp::BasisSet::begin |
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inline |
◆ begin() [2/2]
| std::map< std::string, Element >::const_iterator votca::xtp::BasisSet::begin |
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const |
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inline |
◆ end() [1/2]
| std::map< std::string, Element >::iterator votca::xtp::BasisSet::end |
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inline |
◆ end() [2/2]
| std::map< std::string, Element >::const_iterator votca::xtp::BasisSet::end |
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const |
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inline |
◆ getElement()
| const Element & votca::xtp::BasisSet::getElement |
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std::string |
element_type | ) |
const |
◆ Load()
| void votca::xtp::BasisSet::Load |
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const std::string & |
name | ) |
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◆ Name()
| const std::string & votca::xtp::BasisSet::Name |
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const |
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inline |
◆ operator<<
| std::ostream & operator<< |
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std::ostream & |
out, |
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const BasisSet & |
basis |
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) |
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friend |
◆ elements_
| std::map<std::string, Element> votca::xtp::BasisSet::elements_ |
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private |
◆ name_
| std::string votca::xtp::BasisSet::name_ |
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private |
The documentation for this class was generated from the following files:
