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Re: Calculation of dielectric constant at Freq= 1KHz.. Help needed.

Alex Granovsky
gran@classic.chem.msu.su


Hello,

your input structure is invalid. The terminal C atoms should be properly terminated.

Regards,
Alex Granovsky


On Tue Jul 14 '15 8:41am, Siddheshwar Chopra wrote
--------------------------------------------------
>Dear Users,
>This is the very first time that I have tried finding the dielectric constant using FIREFLY.. I have attached an output file for your reference. I wanted to find the dielectric constant at Frequency=1 KHz. For the same, I have added "1.519835E-13" to the Freq(1) array. I would be really grateful if you all can help me understand HOW to calculate the dielectric constant from the o/p file.
>Also, as you can see, I have used classical calculations here.
>In addition, I request Alex Sir to tell the Frequency range (in KHz) in which we can find the dielectric constant..
>
>
>Kind Regards,


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