Dear Sir, Greetings of the day! I am running a case of 13 different atomic positions and calculating DoS. I run *total 1 tot,s,p,d,f 2 tot,s,p,d,f 3 tot,s,p,d,f 4 tot,s,p,d,f 5 tot,s,p,d,f 6 tot,s,p,d,f 7 tot,s,p,d,f 8 tot,s,p,d,f 9 tot,s,p,d,f 10 tot,s,p,d,f 11 tot,s,p,d,f 12 tot,s,p,d,f 13 tot,s,p,d,f* command to configure case.int file. After that when I run x tetra, then is shows
*mg too small, TETRA does not support more the 51 cases 0.0u 0.0s 0:00.00 0.0% 0+0k 0+0io 0pf+0w* I am unable to understand why is it showing this error? Kindly tell me the solution. Thanks and Regards Peeyush Kumar Kamlesh
_______________________________________________ Wien mailing list Wien@zeus.theochem.tuwien.ac.at http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html