Merge pull request #105 from Exabyte-io/dev

SOF-6892: new hubbard parameters property/results
Exabyte-io · Dec 9, 2023 · 457708a · 457708a
2 parents 0c859eb + 580b8ba
commit 457708a
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Showing 7 changed files with 16 additions and 13 deletions.
diff --git a/.github/workflows/cicd.yml b/.github/workflows/cicd.yml
@@ -12,12 +12,12 @@ jobs:
 
     steps:
       - name: Checkout this repository
-        uses: actions/checkout@v2
+        uses: actions/checkout@v4
         with:
           lfs: true
 
       - name: Checkout actions repository
-        uses: actions/checkout@v2
+        uses: actions/checkout@v4
         with:
           repository: Exabyte-io/actions
           token: ${{ secrets.BOT_GITHUB_TOKEN }}
@@ -38,12 +38,12 @@ jobs:
 #
 #    steps:
 #      - name: Checkout this repository
-#        uses: actions/checkout@v2
+#        uses: actions/checkout@v4
 #        with:
 #          lfs: true
 #
 #      - name: Checkout actions repository
-#        uses: actions/checkout@v2
+#        uses: actions/checkout@v4
 #        with:
 #          repository: Exabyte-io/actions
 #          token: ${{ secrets.BOT_GITHUB_TOKEN }}
@@ -66,12 +66,12 @@ jobs:
 
     steps:
       - name: Checkout this repository
-        uses: actions/checkout@v2
+        uses: actions/checkout@v4
         with:
           lfs: true
 
       - name: Checkout actions repository
-        uses: actions/checkout@v2
+        uses: actions/checkout@v4
         with:
           repository: Exabyte-io/actions
           token: ${{ secrets.BOT_GITHUB_TOKEN }}
@@ -91,12 +91,12 @@ jobs:
 
     steps:
       - name: Checkout this repository
-        uses: actions/checkout@v2
+        uses: actions/checkout@v4
         with:
           lfs: true
 
       - name: Checkout actions repository
-        uses: actions/checkout@v2
+        uses: actions/checkout@v4
         with:
           repository: Exabyte-io/actions
           token: ${{ secrets.BOT_GITHUB_TOKEN }}

diff --git a/npmignore → .npmignore b/npmignore → .npmignore
diff --git a/applications/espresso.yml b/applications/espresso.yml
@@ -1,7 +1,7 @@
 name: espresso
 shortName: qe
 summary: Quantum Espresso
-defaultVersion: '5.4.0'
+defaultVersion: '6.3'
 versions:
   #### version 5.2.1 ####
   - version: '5.2.1'

diff --git a/executables/espresso/hp.x.yml b/executables/espresso/hp.x.yml
@@ -1,11 +1,13 @@
 monitors:
   - standard_output
-results: []
+results:
+  - hubbard_u
 flavors:
   hp:
     input:
       - name: hp.in
-    results: []
+    results:
+      - hubbard_u
     monitors:
       - standard_output
     applicationName: espresso

diff --git a/src/js/allowed_results.js b/src/js/allowed_results.js
@@ -18,4 +18,5 @@ export default [
     "reaction_energy_profile",
     "potential_profile",
     "charge_density_profile",
+    "hubbard_u",
 ];
diff --git a/src/js/data/application_data.js b/src/js/data/application_data.js
diff --git a/src/js/data/tree.js b/src/js/data/tree.js