I'm trying to implement B97-3c (https://aip.scitation.org/doi/10.1063/1.5012601) in PySCF with help of this lib. But it seems B97-3c is not in parameters.toml. Could it be added?
I'm trying to implement B97-3c (https://aip.scitation.org/doi/10.1063/1.5012601) in PySCF with help of this lib. But it seems B97-3c is not in parameters.toml. Could it be added?