I'm using the 10.9.69 pre-release and am getting anomalous results with "spacefill ionic".
With an (abbreviated-for-clarity) file like this for calcite: data_global _cell_length_a 4.988 _cell_length_b 4.988 _cell_length_c 17.061 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_volume 367.611 _symmetry_space_group_name_H-M 'R -3 c' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Ca 0.00000 0.00000 0.00000 C 0.00000 0.00000 0.25000 O 0.25670 0.00000 0.25000 loop_ _atom_type_symbol _atom_type_oxidation_number Ca 2 C 4 O -2 >From the Jmol code, ionic radii should be: C+4: 160 O-2: 1320 Ca+2: 990 but with 'spacefill ionic' command, oxygen is smaller than calcium. Ideas? --Phillip Barak ------------------------------------------------------------------------- Take Surveys. Earn Cash. Influence the Future of IT Join SourceForge.net's Techsay panel and you'll get the chance to share your opinions on IT & business topics through brief surveys -- and earn cash http://www.techsay.com/default.php?page=join.php&p=sourceforge&CID=DEVDEV _______________________________________________ Jmol-users mailing list Jmol-users@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/jmol-users
