[DFTB-Plus-User] MD with Electric Field

Шунаев Владислав vshunaev at list.ru
Thu Mar 31 14:09:48 CEST 2022


Dear Forum!
 
I’ve tried to perform MD simulation with external electric field for K at C60 complex. But after simulation I found that out-files(coordinates, charges, velocities) are the same with and without a presence of ElectricField block. And I can’t find values of EF strength during simulation. Also I can’t find any recipes for MD simulation with EF. The required files are attached. Please help!
    
ElectricField = {
    Strength 1e9
    Direction 1.0 0.0 0.0
    Frequency 5e11
    }
 
 
--
Best regards,
Shunaev Vladislav
PhD, docent
Saratov State University
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