Merge branch 'dev-lct' of https://github.com/QuantumPackage/qp2 into dev-lct

added missing dependency inao_two_e_erf_ints/two_e_integrals_erf.irp.f
2024-09-01 05:33:40 +02:00 · 2019-05-27 15:17:26 +02:00 · 2019-05-27 15:17:10 +02:00
1 changed files with 2 additions and 0 deletions
--- a/src/ao_two_e_erf_ints/two_e_integrals_erf.irp.f
+++ b/src/ao_two_e_erf_ints/two_e_integrals_erf.irp.f
@ -16,6 +16,8 @@ double precision function ao_two_e_integral_erf(i,j,k,l)
  integer                        :: iorder_p(3), iorder_q(3)
  double precision               :: ao_two_e_integral_schwartz_accel_erf
  
+  provide mu_erf
+
   if (ao_prim_num(i) * ao_prim_num(j) * ao_prim_num(k) * ao_prim_num(l) > 1024 ) then
     ao_two_e_integral_erf = ao_two_e_integral_schwartz_accel_erf(i,j,k,l)
     return
Author	SHA1	Message	Date
Barthelemy Pradines LCT	da51f0960b	Merge branch 'dev-lct' of https://github.com/QuantumPackage/qp2 into dev-lct	2019-05-27 15:17:26 +02:00
Barthelemy Pradines LCT	6584a0c707	added missing dependency inao_two_e_erf_ints/two_e_integrals_erf.irp.f	2019-05-27 15:17:10 +02:00