From 74684e477345ed0ae1054c51b09ea75ec9269b3f Mon Sep 17 00:00:00 2001 From: Jean-Luc Fattebert Date: Tue, 25 Nov 2025 11:42:24 -0500 Subject: [PATCH] Fix bug in preconditioner setup * affecting Davidson only --- src/MGmol.cc | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/MGmol.cc b/src/MGmol.cc index 2c61447d..44ee6bf2 100644 --- a/src/MGmol.cc +++ b/src/MGmol.cc @@ -1342,7 +1342,7 @@ double MGmol::computePrecondResidual(OrbitalsType& phi, // PRECONDITIONING // compute the preconditioned steepest descent direction // -> res - orbitals_precond_->precond_mg(res); + precond_mg(res); } return norm2Res;