[adf-list] Reaxff模拟

匍匐Kumar. pravink068在gmail.com
2017年9月20日星期三:2017年9月20日

Hi,

I want to simulate water model using Reaxff. I have all the forcefield
parameter. But if  I am including these parameters as mentioned in SCM
included forcefield *"So if you have the force field information from
somewhere else you can just use it (save it in a text file, and select it
in ADFinput via the Other... option)." *I am getting the following error.

Error reading forcefield file
ERROR DETECTED


Please help me to sort out this problem.

Regards
PRAVEEN KUMAR
Research scholar
INDIAN INSTITUTE OF SCIENCE
EDUCATION AND RESEARCH PUNE, INDIA
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