Fixed a bug that prevented users from using ECPs and the nosegment option at the same time. The dimension of the # integrals calculated in int_ecp.F was wrong, it did not include the contractions. Added the contraction variable and it works properly now.
Fixed a bug that prevented users from using ECPs and the nosegment option at the same time. The dimension of the # integrals calculated in int_ecp.F was wrong, it did not include the contractions. Added the contraction variable and it works properly now.



rangsimanketkaew/NWChem