Sridatri Nandy

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Questions related from Sridatri Nandy

How can i generate my own data set for interatomic potentials of any polymers(purely organic)?

I want to generate a set of interatomic potentials between 5 chains of a polymer. I have all the required parameters to calculate the force field, but I am unable to understand the format of...

25 January 2019 9,174 0 View

How do I install Gaussian09 on my Windows System?

Any relevant references for guidance in the installation of Gaussian09 software. Any help will be much appreciated. Thanks in advance!

18 December 2018 719 2 View

Are there any easy to understand references for Density Functional Theory?

I have just begun reading background theory on Computational Chemistry, and finding it really difficult to understand Density Functional Theory. Are there any suggestions or references to help me...

24 August 2018 3,267 17 View

How can I display the output obtained after each completed cycle towards optimization in GaussView in the output file?

i need to know if there is any keyword that generates the data obtained after each each completed cycle during geometry optimization

20 August 2018 4,296 3 View

How do I calculate the capacitance value from a cyclic voltammetry polarograph?

Basically, how do I interpret any sort of data after voltammetry?

26 October 2015 2,790 3 View