Ali Ramazani | Zanjan University of Medical Sciences

Ali Ramazani

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Questions related from Ali Ramazani

Calculation of HOMO and LUMO

I am looking for calculations of HOMO and LUMO

10 October 2012 9,115 7 View

Does anyone know how to calculate the highest occupied molecular orbital (HOMO) and lowest unoccupied molecular orbital (LUMO) of lead compounds?

Does anyone know how to calculate the highest occupied molecular orbital (HOMO) and lowest unoccupied molecular orbital (LUMO) of lead compounds?

05 May 2012 4,407 0 View

I want to calculate these discriptores for some compounds. 1- Vicinal carbon atoms substitution pattern 2- Sasvol (solvent-accessible volume) 3- V...

Ali ramazani

01 January 2012 6,445 0 View