GSAS: using restraints as diagnostics

• Restraints don’t have to be enabled to exist inside GSAS

• Restraints can also be used diagnostically even if they are not enabled

• E.g., Charge Balance :

• Following screen dumps shows that the occupancies of the various metals are such that the total cell is out of charge balance.

  • In EXPEDT: k l s c l ! last l is for list

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