Deer 3p soft diag.m
Complete set of simulations related to three-pulse DEER. Runs echo diagnostocs followed by DEER simulation. Syntax:
deer_3p_soft_diag(spin_system,parameters)
Parameters:
parameters.pulse_frq - frequencies for the
three pulses, Hz
parameters.pulse_pwr - power levels for the three
pulses, Hz
parameters.pulse_dur - durations for the three
pulses, seconds
parameters.pulse_phi - initial phases for the three
pulses, radians
parameters.pulse_rnk - Fokker-Planck ranks for the
three pulses
parameters.offset - receiver offset for the time
domain detection, Hz
parameters.sweep - sweep width for time domain
detection, Hz
parameters.npoints - number of points in the free
induction decay
parameters.rho0 - initial state
parameters.coil - detection state
parameters.p1_p3_gap - time between the first and the
third pulses, seconds
parameters.p2_nsteps - number of second pulse posi-
tions in the interval between
the first and the third pulse
parameters.echo_time - time to sample around the ex-
pected echo position
parameters.echo_npts - number of points in the echo
discretization
parameters.method - soft puse propagation method,
'expv' for Krylov propagation,
'expm' for exponential propa-
gation, 'evolution' for Spin-
ach evolution function