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Questions related from Santosh Dhungana
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I had performed homo lumo calulation of abametapir molecule (C12H12N2)in different polar and non polar solvents like water , DMSO, DIETEHYL ETHER , CCL4. THE frontier energy gap in polar solvents...
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For simply to perform any gaussian calculation in solvent phase and anion state or cation state , what should i optimize either solvent phase or anion state to obtain more precise result.
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