Check out the recent work on the photohydrolysis of furans by List et al., with contributions from Benjamin Helmich-Paris. For a quick start on GOAT, DLPNO-CCSD(T), and more also check our ORCA tutorials www.faccts.de/docs/orca/tu....
doi.org/10.1126/scie...
#MPIKOFO #FACCTs #CompChem #ORCAqc
100000 registered ORCA users!
What an incredible Christmas gift!
The #ORCA community has reached a major milestone: 100,000 registered users.
Thank you all for your trust and for being such an important part of ORCA’s journey. Your support is what makes this success possible.
#ORCAqc #FACCTs #MPIKOFO #CompChem #ChemSky
Missed the ORCA 6.1 release event? All talks are now online on our YouTube channel!
www.youtube.com/@faccts_orca
ORCA 6.1 Release Event Playlist:
www.youtube.com/watch?v=mRSk...
#ORCA61 #ORCAqc #FACCTs #MPIKOFO #CompChem #QuantumChem #ChemSky #CompChemSky
The ORCA 6.1 online release event starts soon (12:00 CET), we hope to see you there!
ZOOM Webinar: eu02web.zoom-x.de/j/6815327020...
Passcode: 297206
#ORCA61 #ORCAqc #CompChem #QuantumChem #TheoChem #ChemSky #CompChemSky #FACCTs #MPIKOFO
New methods in ORCA 6.1. Bubblepoles, MCPDFT, ADFT, NEVPT3, NEVPT4(SD)
ORCA 6.1 will be released tomorrow after the online event to which you are all invited! As a final appetiser, we have a sneak preview of some new methods that will be available in the new version.
#ORCA61 #ORCAqc #CompChem #QuantumChem #TheoChem #FACCTs #MPIKOFO #ChemSky #CompChemSky