pwtools._dcd.read_dcd_data_from_unit¶
- pwtools._dcd.read_dcd_data_from_unit = <fortran function read_dcd_data_from_unit>¶
cryst_const,coords = read_dcd_data_from_unit(unt,nstep,natoms,convang)
Wrapper for
read_dcd_data_from_unit
.- Parameters:
unt (input int)
nstep (input int)
natoms (input int)
convang (input int)
- Returns:
cryst_const (rank-2 array(‘d’) with bounds (nstep,6))
coords (rank-3 array(‘f’) with bounds (nstep,natoms,3))