Hi!
I need to draw several crystal structures that do not have the data for the positions of all Hs or Os, but rather only -OHs and waters. is there a way to represent this without arbitratily picking a direction for the hydrogens? Is there a way to determine the most energetically favorable H positions?
Thanks for any help!
I need to draw several crystal structures that do not have the data for the positions of all Hs or Os, but rather only -OHs and waters. is there a way to represent this without arbitratily picking a direction for the hydrogens? Is there a way to determine the most energetically favorable H positions?
Thanks for any help!