[molpro-user] too many mass redefinitions

lydia theochemly at gmail.com
Mon Aug 24 09:41:08 BST 2015

Dear all,
I have a loop calculation with "do" and "enddo" , and also define the mass of each atom, but it stops at the 53th point (the number of total points is more than 100) and shows "too many mass redefinitions". 
How to solve this problem?


发自我的 iPhone
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://www.molpro.net/pipermail/molpro-user/attachments/20150824/5004b944/attachment.html>

More information about the Molpro-user mailing list