[Pw_forum] how to judge movement of HOMO and LUMO

[Rajdeep Banerjee]

Dear Prof. Nicola Marzari,
                                     thank you very much for your excellent
suggestions. I'll surely look deep into the matter and report back to you
as soon as I can.

Thanks,
Rajdeep Banerjee
JNCASR
Bangalore , India
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