[DFTB-Plus-User] Born charges and deriv charges

[Hafid KHALFOUN]

Dear Balint ,

Can you be more explicit about getting the born charges and the deriv
charges , please ?
How do they be related to the SecondDerivatives{} option ?

Thanks
Hafid
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://mailman.zfn.uni-bremen.de/pipermail/dftb-plus-user/attachments/20230314/72c45422/attachment.htm>