[Pw_forum] PLUMED and Quantum-ESPRESSO
Giovanni La Penna
glapenna at iccom.cnr.it
Wed Jun 10 16:55:50 CEST 2015
Dear Quantum-ESPRESSO users and developers,
The patch to plug PLUMED 2.0.5 into quantum-espresso 5.0.2
(as released in the PLUMED 2.0.5 distribution)
works only on the PW code. Does this mean that any project
to plug PLUMED 2.0 into the Quantum-ESPRESSO CP code
has been abandoned? I hope not.
Any experimental patch of PLUMED 2.0 (PLUMED 1.0 works
fine) for Quantum-ESPRESSO/CP (5.0.2 or later)
is welcome for testing.
Thank you,
Giovanni La Penna
National research council of Italy (CNR)
Institute for chemistry of organometallic compounds (ICCOM)
Sesto Fiorentino (Firenze), Italy
tel.: +39 0555225264 / skype: giovannilapenna
More information about the users
mailing list