[CPMD-list] TESR with water molecules calculation

Przemyslaw Dopieralski mclar at elrond.chem.uni.wroc.pl
Tue Aug 30 12:40:45 CEST 2005

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Hi :)


I'm trying to calculate ion with water molecules should I use TESR option?


Przemyslaw Dopieralski
Ph.D. student
University od Wroclaw
POLAND

e-mail: mclar at elrond.chem.uni.wroc.pl

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