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desorption

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sata-deep / TPD-Satadeep

This program calculates the temperature programmed desorption rate. Once initial coverage, heating rate, desorption energy are provided the program solves Polyani-Wigner equation differential equation using 4th order Runge Kutta method and prints the coverage and rate in a two columned file "Coverage.dat".

temperature tpd programmed desorption

Updated Jun 11, 2018

pjasmin1046 / Thermodynamic-Simulations

Series of simulations analyzing common chemical engineering, thermodynamic, and kinetic phenomena

reactions monte-carlo-simulations adsorption desorption mass-balances fugacity energy-balances

Updated Mar 4, 2024
Python

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