MADNESS
version 0.9
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#include <atom.h>
Public Member Functions | |
Hydrogen (Vector< double, 3 > &c) | |
virtual int | dimBasis () const |
Public Member Functions inherited from madness::Atom | |
Atom (double x, double y, double z, double q, unsigned int atomic_number) | |
Atom (const Atom &a) | |
Atom () | |
Default construct makes a zero charge ghost atom at origin. More... | |
madness::Vector< double, 3 > | get_coords () const |
template<typename Archive > | |
void | serialize (Archive &ar) |
Additional Inherited Members | |
Public Attributes inherited from madness::Atom | |
double | x |
double | y |
double | z |
double | q |
Coordinates and charge in atomic units. More... | |
unsigned int | atomic_number |
Atomic number. More... | |
Hydrogen atom.
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inlinevirtual |