MPQC
3.0.0-alpha
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Classes | |
struct | Iteration |
Public Types | |
typedef std::atomic_uint_fast64_t | accumulate_t |
Public Member Functions | |
void | global_sum (const Ref< MessageGrp > &msg) const |
Iteration & | next_iteration () |
void | print_summary (std::ostream &out, const Ref< GaussianBasisSet > &basis, const Ref< GaussianBasisSet > &dfbs, const CADFCLHF *parent, int print_level=-1, bool new_exchange=false) const |
Public Attributes | |
decltype(accumulate_t().load()) typedef | count_t |
bool | histogram_mode = false |
accumulate_t | sig_pairs = { 0 } |
accumulate_t | sig_pairs_fxn = { 0 } |
int | print_level = 0 |
bool | xml_stats_saved = false |
std::vector< Iteration > | iterations |