Dear all,
I have a solvent. but kspace_style pppm can not simulate it. waters model is tip4p. can i use kspace_style ewald for tip4p water model?
thanks alot.
mousavi
Dear all,
I have a solvent. but kspace_style pppm can not simulate it. waters model is tip4p. can i use kspace_style ewald for tip4p water model?
thanks alot.
mousavi
Dear all,
I have a solvent.
what solvent?
but kspace_style pppm can not simulate it.
why?
waters model is tip4p. can i use kspace_style ewald for tip4p water model?
depends. have you tried?
axel.