<![CDATA[Multiwfn forum / HOMAc and HOMER aromaticity indices have been supported in Multiwfn]]> //www.umsyar.com/wfnbbs/viewtopic.php?id=1601 The most recent posts in HOMAc and HOMER aromaticity indices have been supported in Multiwfn. Tue, 04 Feb 2025 20:09:04 +0000 FluxBB <![CDATA[HOMAc and HOMER aromaticity indices have been supported in Multiwfn]]> //www.umsyar.com/wfnbbs/viewtopic.php?pid=4876#p4876

New update today:

New aromaticity indices, HOMAc and HOMER, which were proposed in Phys. Chem. Chem. Phys., 25, 16763 (2023) and J. Org. Chem., 90, 1297 (2025), respectively, have been supported. They are reparameterized versions of HOMA. HOMAc performs better than HOMA in determining S0 state aromaticity, and HOMER is able to characterize aromaticity in T1 state (HOMA is fully failed for this case). HOMAc and HOMER can be calculated by subfunctions 6a and 6b in main function 25, respectively. See Section 3.28.7 of Multiwfn manual for more information.

dummy@example.com (sobereva) Tue, 04 Feb 2025 20:09:04 +0000 //www.umsyar.com/wfnbbs/viewtopic.php?pid=4876#p4876
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