[CPMD-list] constraint force in file CONSTRAINT
chenghuiqc
chenghuiqc at sina.com
Fri Dec 27 09:44:10 CET 2002
Dear cpmd-list all,
I want to know does the file CONSTRAINT in cpmd contains any information about the force on the constraint, or are there other
methods to produce the result the force on the constraint.
chenhui
Dept Chem, Nanjing Univ
P.R.China
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