! Model. 1 for COSMO, 2 for PCM and 3 for LPB
! Whether to compute (1) or not (0) forces
! Dielectric permittivity constant
! Debye H\"{u}ckel parameter
! Regularization parameter
! Shift of the regularized characteristic function
! Maximal degree of modeling spherical harmonics
! Approximate number of Lebedev grid points
! Jacobi/DIIS iterative solver
! Relative threshold for the iterative solver
! Maximum number of iterations
! Number of DIIS extrapolation points
! Whether to use (1) or not (0) the FMM
! Max degree of multipole spherical harmonics for the FMM
! Max degree of local spherical harmonics for the FMM
! Printing flag. The larger, the more verbose the output
! Number of OpenMP cores to be used
! number of spheres
! coordinates, charges, radii
removing --> ! Whether to precompute (1) or not (0) the FMM translations
Here is the proposition
! Model. 1 for COSMO, 2 for PCM and 3 for LPB ! Whether to compute (1) or not (0) forces ! Dielectric permittivity constant ! Debye H\"{u}ckel parameter ! Regularization parameter ! Shift of the regularized characteristic function ! Maximal degree of modeling spherical harmonics ! Approximate number of Lebedev grid points ! Jacobi/DIIS iterative solver ! Relative threshold for the iterative solver ! Maximum number of iterations ! Number of DIIS extrapolation points ! Whether to use (1) or not (0) the FMM ! Max degree of multipole spherical harmonics for the FMM ! Max degree of local spherical harmonics for the FMM ! Printing flag. The larger, the more verbose the output ! Number of OpenMP cores to be used ! number of spheres ! coordinates, charges, radii
removing --> ! Whether to precompute (1) or not (0) the FMM translations