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Dokumentacja PLGrid
Usługi wycofane
Chemia (wycofane)
Chemia: InSilicoLab for Chemistry (wycofane)
Quantum Chemistry Advisor
Page History
Versions Compared
Old Version
6
changes.mady.by.user
Klemens Noga
Saved on
Feb 15, 2015
compared with
New Version
7
changes.mady.by.user
Klemens Noga
Saved on
Feb 15, 2015
Previous Change: Difference between versions 5 and 6
Next Change: Difference between versions 7 and 8
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Method
Gaussian
Turbomole
Molpro
GAMESS
NWChem
ORCA
Terachem
ADF
RHF
freq
freq
RI
grad
freq
freq
freq
grad
UHF
freq
freq
RI
grad
grad
freq
freq
grad
ROHF
freq
freq
RI
grad
freq
grad
freq
grad
DFT
freq
freq
RI
grad
grad
freq
freq
grad
freq
Available DFT functionals
...
Overview
Content Tools
{"serverDuration": 274, "requestCorrelationId": "11aebf9cea2f2ea0"}