pyGAPS
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pauliacomi
A framework for processing adsorption data and isotherm fitting
Several improvements should be made to the fraction/percent modes. First, both should be an alias of a single "fractional" mode with different conversion factors. Then, must ensure that loading and...
recorded high pressure isotherms are usually excess isotherms allow for conversion to absolute and back
some apparatuses include a saturation pressure measurement for each isotherm point ensure this is accounted for in internal logic and parsing
Hi, I am a graduate student and my study is about liquid phase adsorption (fuel oil). Your lib is amazing, but I find it seems a pity that the liquid...
I know this code mainly a framework for processing adsorption data and isotherm fitting but, it is sad that it contains only 1 example kernel for dft calculations, although it...
Adsorbate properties in database are in various units. Should transform all in SI and then do specific conversions where needed.
Uncertainties in BET/Langmuir areas etc
As discussed this morning. - p_sat derived from adsorbate properties or as pseudo-saturation (see line 111) - Your liquefaction enthalpy function in Adsorbate class is only temperature (not pressure) dependent....
As discussed - hope you get a chance to look at it! Scott
It's important for certain calculations as in conversion between net, excess, and absolute (see #39) to know how the isotherm was measured. I'd see this looking like; 1. Add an...
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A framework for processing adsorption data and isotherm fitting