Upgrade QE to 7.4 in docker image and app core (#1119)

Dockerfile

@@ -1,7 +1,7 @@
 # syntax=docker/dockerfile:1
 ARG FULL_STACK_VER=2025.1025
 ARG UV_VER=0.4.7
-ARG QE_VER=7.2
+ARG QE_VER=7.4
 ARG QE_DIR=/opt/conda/envs/quantum-espresso-${QE_VER}
 ARG HQ_VER=0.19.0
 

src/aiidalab_qe/app/parameters/qeapp.yaml

@@ -27,18 +27,18 @@ advanced:
 ## Computational resources
 codes:
     dos:
-        code: dos-7.2@localhost
+        code: dos-7.4@localhost
     projwfc:
-        code: projwfc-7.2@localhost
+        code: projwfc-7.4@localhost
     projwfc_bands:
-        code: projwfc-7.2@localhost
+        code: projwfc-7.4@localhost
     pw:
-        code: pw-7.2@localhost
+        code: pw-7.4@localhost
     pp:
-        code: pp-7.2@localhost
+        code: pp-7.4@localhost
     xspectra:
-        code: xspectra-7.2@localhost
+        code: xspectra-7.4@localhost
     hp:
-        code: hp-7.2@localhost
+        code: hp-7.4@localhost
 
 summary_format: list

src/aiidalab_qe/common/setup_codes.py

@@ -16,7 +16,7 @@
 
 class QESetupWidget(ipw.VBox):
     """The QE setup widget checks whether there are codes that match specific expected
-    labels (e.g. "pw-7.2@localhost") and triggers both the installation of QE into a
+    labels (e.g. "pw-7.4@localhost") and triggers both the installation of QE into a
     dedicated conda environment and the setup of the codes in case that they are not
     already configured.
     """

src/aiidalab_qe/setup/codes.py

@@ -12,7 +12,7 @@
 FN_SETUP_LOCKFILE = Path.home().joinpath(".setup-qe-on-localhost.lock")
 FN_DO_NOT_SETUP = Path.cwd().joinpath(".do-not-setup-on-localhost")
 
-QE_VERSION = "7.2"
+QE_VERSION = "7.4"
 
 
 def get_qe_env():