From 28cb4a516702fe0da6b2a7e63b0f1fe8d5cb9b10 Mon Sep 17 00:00:00 2001 From: Anthony Scemama Date: Fri, 23 Oct 2020 11:35:45 +0200 Subject: [PATCH] Change default in davidson --- src/davidson/EZFIO.cfg | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/davidson/EZFIO.cfg b/src/davidson/EZFIO.cfg index f820730c..4343cc1e 100644 --- a/src/davidson/EZFIO.cfg +++ b/src/davidson/EZFIO.cfg @@ -8,7 +8,7 @@ default: 1.e-10 type: logical doc: Thresholds of Davidson's algorithm is set to E(rPT2)*threshold_davidson_from_pt2 interface: ezfio,provider,ocaml -default: true +default: false [n_states_diag] type: States_number