Fix bug #67

sunqm · May 3, 2022 · 7b9c62d · 7b9c62d
1 parent 93d6e17
commit 7b9c62d
Showing 1 changed file with 1 addition and 1 deletion.
diff --git a/src/cint3c1e.c b/src/cint3c1e.c
@@ -497,7 +497,7 @@ CACHE_SIZE_T int3c1e_cart(double *out, FINT *dims, FINT *shls, FINT *atm, FINT n
         CINTEnvVars envs;
         CINTinit_int3c1e_EnvVars(&envs, ng, shls, atm, natm, bas, nbas, env);
         envs.f_gout = &CINTgout3c1e;
-        return CINT3c1e_drv(out, dims, &envs, opt, cache, &c2s_cart_1e, 0, 0);
+        return CINT3c1e_drv(out, dims, &envs, opt, cache, &c2s_cart_3c1e, 0, 0);
 }
 
 CACHE_SIZE_T int3c1e_spinor(double complex *out, FINT *dims, FINT *shls, FINT *atm, FINT natm,