Has anyone had the opportunity to use the dreiding force filed with RASPA? If so, would it be possible to post some simple examples of your input files? Many thanks!
Anthony
Anthony
- Welcome to iRASPA Community.
This section allows you to view all posts made by this member. Note that you can only see posts made in areas you currently have access to.
Pages1
#2
Input files and parameters / Re: Density histograms
February 17, 2021, 05:46:06 PM
I have also tried to use this function without sucess. This function is listed in the RASPA manual on page 30:
ComputeDensityHistograms [yesjno]
Sets whether or not to compute a density histogram for the current system. For example, during
adsorption it keeps track of the amount of molecules.
Is there a way to obtain this information without using VTK?
Anthony
ComputeDensityHistograms [yesjno]
Sets whether or not to compute a density histogram for the current system. For example, during
adsorption it keeps track of the amount of molecules.
Is there a way to obtain this information without using VTK?
Anthony
Pages1