From ccda67bf51f919695c26231d1587793bddc3e8c3 Mon Sep 17 00:00:00 2001 From: Sarath Menon Date: Thu, 7 Sep 2023 11:40:15 +0200 Subject: [PATCH] Update input.yaml --- examples/example_02/input.yaml | 1 + 1 file changed, 1 insertion(+) diff --git a/examples/example_02/input.yaml b/examples/example_02/input.yaml index e994986..407704f 100644 --- a/examples/example_02/input.yaml +++ b/examples/example_02/input.yaml @@ -29,6 +29,7 @@ md: timestep: 0.001 thermostat_damping: 0.1 barostat_damping: 0.1 + equilibration_control: nose_hoover queue: scheduler: local