Octopus
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Implements a the 4th order Runge Kutta propagator. More...
Implements a the 4th order Runge Kutta propagator.
Definition at line 127 of file propagator_rk4.F90.
Additional Inherited Members | |
Public Attributes inherited from propagator_oct_m::propagator_t | |
class(system_t), pointer, public | system |
The system using this propagator. More... | |
real(real64), public | dt |
Physical duration of one time step. More... | |
real(real64), public | final_time = M_ZERO |
The final time of the simulation. More... | |
logical, public | inside_scf = .false. |
Indicate whether the system is executing an SCF loop. More... | |
logical, public | predictor_corrector = .false. |
integer, public | scf_count |
Counter for self-consistency iterations. More... | |
integer, public | max_scf_count |
Maximum number of iterations for self-consistent propagators. More... | |
integer, public | accumulated_loop_ticks |
real(real64), public | scf_tol |
Tolerance for self-consistent propagators. More... | |
Public Attributes inherited from algorithm_oct_m::algorithm_t | |
type(algorithm_iterator_t), public | iter |
Iterator for algorithmic operations. More... | |
type(algorithmic_operation_t), public | start_operation |
algorithm specific initialization operation; More... | |
type(algorithmic_operation_t), public | final_operation |
algorithm specific finalization operation More... | |
integer, public | algo_steps |
Number of 'algorithmic steps' per algorithmic iteration. More... | |
type(iteration_counter_t), public | iteration |
Keep track at which iteration this algorithm is. More... | |
real(real64), public | elapsed_time = M_ZERO |
Elapsed wall clock time for printing info. More... | |
Public Attributes inherited from linked_list_oct_m::linked_list_t | |
integer, public | size = 0 |