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Topics - Pezhman Zarabadi-Poor

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Simulation algorithms and theory / Heat Capacity (MC-NPT)
« on: March 30, 2018, 03:59:33 PM »
Dear All,

I am wondering if you may provide me documentation about the theory behind the printed heat capacity in RASPA output entitled with MC-NPT while simulating gas adsorption isotherms through GCMC approach.

Thank you in advance.

My best regards,

Visualization / Mult. Val. Adsorption Surfaces
« on: March 30, 2018, 03:39:31 PM »
Dear David,

I would like to visualize adsorption surfaces similar to Figure 14 of iRASPA paper. I am wondering how it possible to have Multiple Values for Isocontour value and Opacity as well as different assigned colors?

Thank you in advance.

My best,

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