FW: About Eover in ReaxFF with atom species which have its mass > 21 g / mol

Dear whom may concern this

Couple of days ago, I reported one false alarming about the Reax Potential code.

Today, I found that my code has wrong defitnion on the number of lone pair electron and valence number.

Sorry for bothering if there is anyone who had involved to my previous email.

Best regards,


Lammps_error_report.pptx (329 KB)