From fa62d90179c6e208285bc303717242a49b043999 Mon Sep 17 00:00:00 2001 From: Kristjan Eimre Date: Mon, 11 Jul 2022 12:55:18 +0000 Subject: [PATCH 1/2] increase time limit for pdos workchain --- pdos/pdos_workchain.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/pdos/pdos_workchain.py b/pdos/pdos_workchain.py index d126b53..5a2e2b0 100644 --- a/pdos/pdos_workchain.py +++ b/pdos/pdos_workchain.py @@ -134,7 +134,7 @@ def run_overlap(self): inputs['metadata']['options'] = { "resources": {"num_machines": n_machines}, - "max_wallclock_seconds": 10600, + "max_wallclock_seconds": 86400, } settings = Dict(dict={'additional_retrieve_list': ['overlap.npz']}) From c487e8684822ecf0f5db6a1cd31acb4d3c6ad2ad Mon Sep 17 00:00:00 2001 From: Kristjan Eimre Date: Mon, 11 Jul 2022 12:56:42 +0000 Subject: [PATCH 2/2] prepare release 1.8.4 --- setup.cfg | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/setup.cfg b/setup.cfg index 01a3a31..01d6121 100644 --- a/setup.cfg +++ b/setup.cfg @@ -3,7 +3,7 @@ title = Empa nanotech@surfaces Laboratory - Scanning Probe Microscopy [metadata] name = scanning_probe -version = 1.8.3 +version = 1.8.4 author = nanotech@surfaces laboratory, Empa description = App to run scanning probe microscopy simulations. long_description = file: README.md