SIMS particulars

• Specific purpose (boundary element method of solution of Poisson for mol. in polar solvent)
  
  
• Requirements (good numerical accuracy to produce stable,reliable results)
  
  
  • maximum homogeneity
    
    
  • adequate smoothing of singularities
    
    
  • stability under variation of dot density
    
    
  • independence of rotation of the molecule
    
    
  • stability under change in the mol. conformation
  
  
• Existing software (MSEED, MSEED-DOT, Connoly MS, Varshney MS)