debug embedding

cp2k · Jun 17, 2019 · d68c46e · d68c46e
1 parent f9d252f
commit d68c46e
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Showing 3 changed files with 191 additions and 193 deletions.
diff --git a/src/force_env_methods.F b/src/force_env_methods.F
@@ -1715,7 +1715,6 @@ SUBROUTINE dfet_embedding(force_env, ref_subsys_number, energies, converged_embe
          ENDDO
          embed_pot%pw%cr3d(:, :, :) = embed_pot%pw%cr3d(:, :, :)+opt_embed%pot_diff%pw%cr3d(:, :, :)
          IF (.NOT. opt_embed%grid_opt) CALL pw_copy(embed_pot%pw, opt_embed%const_pot%pw)
-         DEALLOCATE (rhs)
 
       ENDIF