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Hello. I have seen this post #66 that mentions ECP integrals, and I know that pyscf has ECP integrals implemented, but I cannot find any related information in libcint documents. Does libcint support ECP integrals?
Hello. I have seen this post #66 that mentions ECP integrals, and I know that pyscf has ECP integrals implemented, but I cannot find any related information in libcint documents. Does libcint support ECP integrals?