Dear Wien2k users, We have just installed wien2k in a laptop(COMPAQ) having core2duo processor. Wien2k has been installed properly after compilation of all files. To test it for Fe when we use structural parameters of Fe then after doing x nn it is giving following error :
* argv1: subscript out of range* and we are not able to go any further. In this regard any response will be very useful to us. Thanks in advance. with regards, -- Shamik Chakrabarti Research Scholar Dept. of Physics & Meteorology Material Processing & Solid State Ionics Lab IIT Kharagpur Kharagpur 721302 INDIA -------------- next part -------------- An HTML attachment was scrubbed... URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20110527/c225a9d5/attachment.htm>