--- trunk/src/applications/staticProps/StaticProps.ggo 2014/08/13 17:23:00 2014 +++ trunk/src/applications/staticProps/StaticProps.ggo 2014/08/13 20:42:43 2015 @@ -33,6 +33,8 @@ option "radius" - "nanoparticle radius" option "begin" - "begin internal index" int no option "end" - "end internal index" int no option "radius" - "nanoparticle radius" double no +option "voxelSize" v "voxel size (angstroms)" double no +option "gaussWidth" - "Gaussian width (angstroms)" double no defgroup "staticProps" groupdesc=" an option of this group is required" yes groupoption "bo" - "bond order parameter (--rcut must be specified)" group="staticProps" groupoption "ior" - "icosahedral bond order parameter as a function of radius (--rcut must be specified)" group="staticProps" @@ -60,6 +62,7 @@ groupoption "tet_param_z" - "spatially-resolved te groupoption "rodlength" - "length of nanorod" group="staticProps" groupoption "tet_param" Q "tetrahedrality order parameter (Qk)" group="staticProps" groupoption "tet_param_z" - "spatially-resolved tetrahedrality order parameter Qk(z)" group="staticProps" +groupoption "tet_param_xyz" - "volume-resolved tetrahedrality order parameter Qk(x,y,z). (voxelSize, rcut, and gaussWidth must be specified)" group="staticProps" groupoption "rnemdz" - "slab-resolved RNEMD statistics (temperature, density, velocity)" group="staticProps" groupoption "rnemdr" - "shell-resolved RNEMD statistics (temperature, density, angular velocity)" group="staticProps" groupoption "rnemdrt" - "shell and angle-resolved RNEMD statistics (temperature, density, angular velocity)" group="staticProps"