Bug fix for the fraction $\alpha$ of Fock-type exchange not being correctly propagated to the two-center integration routines, when using the global hybrid functional B3LYP. This unfortunately necessitates to recalculate the associated regression tests and to create a bug fix release as soon as possible.
Bug fix for the fraction $\alpha$ of Fock-type exchange not being correctly propagated to the two-center integration routines, when using the global hybrid functional B3LYP. This unfortunately necessitates to recalculate the associated regression tests and to create a bug fix release as soon as possible.