From 93a0b09b88089a4be0086bb416db56f4adce40a6 Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Fri, 24 Oct 2025 05:52:42 +0200 Subject: [PATCH 1/2] Update environment.yml --- example_workflows/quantum_espresso/environment.yml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/example_workflows/quantum_espresso/environment.yml b/example_workflows/quantum_espresso/environment.yml index 962ad20..1ae715d 100644 --- a/example_workflows/quantum_espresso/environment.yml +++ b/example_workflows/quantum_espresso/environment.yml @@ -5,5 +5,5 @@ dependencies: - matplotlib=3.10.1 - xmlschema=3.4.3 - optimade=1.2.3 -- qe=7.4 +- qe=7.5 - qe-tools=2.0.0 From 960bd1201d17c9fa218ce2e1afb92501e6097358 Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Fri, 24 Oct 2025 05:57:02 +0200 Subject: [PATCH 2/2] Add files via upload --- .../qe_xml_parser/src/qe_xml_parser/schemas/qes_230310.xsd | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/example_workflows/quantum_espresso/qe_xml_parser/src/qe_xml_parser/schemas/qes_230310.xsd b/example_workflows/quantum_espresso/qe_xml_parser/src/qe_xml_parser/schemas/qes_230310.xsd index 2394151..36b6b4e 100644 --- a/example_workflows/quantum_espresso/qe_xml_parser/src/qe_xml_parser/schemas/qes_230310.xsd +++ b/example_workflows/quantum_espresso/qe_xml_parser/src/qe_xml_parser/schemas/qes_230310.xsd @@ -1036,7 +1036,7 @@ datecode 220603 - +