[QE-users] Schrödinger & Kohn: A Stack Exchange for the modeling of molecules and materials

Rashid Rafeek V Valappil rashidr at iiserb.ac.in
Thu Apr 2 17:56:22 CEST 2020


Dear All,

On the 18th of April, the Stack Exchange network (which hosts
StackOverflow, MathOverflow, and many other Q/A sites) is anticipated to
launch a site called "Schrödinger & Kohn" in two stages. People who
register now will be invited to participate in the first stage, during
which the scope and future of this site is decided for 2 weeks, before the
final launch opens universally.

More than 190 people have already signed up. If you or any of your group
members might be interested in having a say in this community's scope or
organization, please follow the steps below to register to the site:

*1) *Log into Stack Exchange: https://stackexchange.com
*2) *Visit the Stack Exchange staging zone for new sites:
https://area51.stackexchange.com/
*3)* When you click "sign up" it will automatically log you in with your
Stack Exchange credentials
*4)* The materials modeling site is then here:
https://area51.stackexchange.com/proposals/122958/materials-modeling?referrer=OWJmN2MxOWQ5ZjQ5NDQ5NWFlNDRjOWYzNjNiMWRjYjAxMjA4NGE2MmUyYjQ1NDQ0NDFhYzRkMjEzZmZlNGZkNJVYNM_b97JfvwNIZroMyCql4XhhRD2FJqfkBrtTfajj0
*5)* Click "commit" and then you will get a verification code in your email.

Proposed topics so far have been related to the usage of VASP,
QuantumEspresso, OpenMOLCAS, CFOUR, GAUSSIAN, LAMMPS, CP2K, DIRAC,
Turbomole, MOLPRO, ORCA, MRCC, ADF, PySCF, PSI4, DALTON, QChem, CASTEP,
CPMD, ABINT, DFTB+, ABAQUS, OpenBabel, MPQC, NWChem, MOLDEN, GAMMES(US),
GAMMES(UK), HORTON, NECI, DICE, OpenFermion, HANDE, but there is still time
to expand the scope to more software. If your group has software that is
not yet represented, you may wish to have someone register for the 2-week
staging period during which the scope and future of this site will be
determined.

With best wishes!
Rashid Rafeek
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