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MPQC
3.0.0-alpha
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This is the complete list of members for sc::Atom, including all inherited members.
| Atom(int Z, double x, double y, double z, const std::string &label, double mass=0, int have_charge=0, double charge=0, int have_fragment=0, int fragment=0) | sc::Atom | inline |
| Atom(int Z, double x, double y, double z, const char *label=0, double mass=0, int have_charge=0, double charge=0, int have_fragment=0, int fragment=0) | sc::Atom | inline |
| Atom() | sc::Atom | inline |
| Atom(const Atom &other) (defined in sc::Atom) | sc::Atom | inline |
| charge() const (defined in sc::Atom) | sc::Atom | inline |
| fragment() const (defined in sc::Atom) | sc::Atom | inline |
| FromStateIn(Atom &a, StateIn &so, int &count) | sc::Atom | friend |
| have_charge() const (defined in sc::Atom) | sc::Atom | inline |
| have_fragment() const (defined in sc::Atom) | sc::Atom | inline |
| label() const (defined in sc::Atom) | sc::Atom | inline |
| mass() const (defined in sc::Atom) | sc::Atom | inline |
| r(int xyz) | sc::Atom | inline |
| r(int xyz) const (defined in sc::Atom) | sc::Atom | inline |
| r() | sc::Atom | inline |
| r() const (defined in sc::Atom) | sc::Atom | inline |
| Z() const | sc::Atom | inline |