[DFTB-Plus-User] Ionic Liquid with DFTB

Debasis Sengupta dxs at cfdrc.com
Mon Oct 10 23:01:54 CEST 2011

Has anybody tried any calculations of ionic liquid (containing C, H, N 
and O) with DFTB?  Any information on its accuracy with DFT will be very 
Thanks in advance,

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