Hi, all
In the help of MS sorption, it is written that "A single simulation is carried out as described for a fixed pressure simulation
. The simulation for the first fugacity in the range starts with an empty framework (the 3D periodic structure that was in focus at the start of the Sorption run). Subsequent simulations start from the configuration reached at the end the previous simulation."
I want to know how can I perform a fixed pressure simulation starting from a previous result of a fixed pressure run? Because in isotherm simulation mode, the fugacity can only be set to increases linearly, which is not the case of real gas.
Thank you.