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votca 2026-dev
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#include <trapfinder.h>

Public Attributes | |
| std::vector< double > | eigenvalues |
| the smallest eigenvalues of -Q (relaxation rates, 1/s) | |
| double | gap = 0.0 |
| Index | slow_modes = 0 |
| std::vector< Trap > | traps |
| std::vector< double > | occupation |
Definition at line 99 of file trapfinder.h.
| std::vector<double> votca::xtp::TrapFinder::Result::eigenvalues |
the smallest eigenvalues of -Q (relaxation rates, 1/s)
Definition at line 101 of file trapfinder.h.
| double votca::xtp::TrapFinder::Result::gap = 0.0 |
Definition at line 102 of file trapfinder.h.
| std::vector<double> votca::xtp::TrapFinder::Result::occupation |
Definition at line 105 of file trapfinder.h.
| Index votca::xtp::TrapFinder::Result::slow_modes = 0 |
Definition at line 103 of file trapfinder.h.
| std::vector<Trap> votca::xtp::TrapFinder::Result::traps |
Definition at line 104 of file trapfinder.h.