update wte

mlip_arena/tasks/diatomics/run.ipynb

@@ -31,7 +31,6 @@
    "cell_type": "markdown",
    "id": "02ff9cf9-49a2-4cec-80d3-56c6661a513b",
    "metadata": {
-    "jp-MarkdownHeadingCollapsed": true,
     "tags": []
    },
    "source": [

mlip_arena/tasks/diatomics/vasp/homonuclear-diatomics.json

@@ -1,3 +1,3 @@
 version https://git-lfs.github.com/spec/v1
-oid sha256:b8588dc4d4e203bf8f77f7f1b9736ac3446185084c67a1ad1cfbf0ec4c08e4ed
-size 11785
+oid sha256:b49606a91ae54a1f31579be8dfbca61555a66229bccefc7fabf653b124ea5cf9
+size 12864

mlip_arena/tasks/eos/run.ipynb

@@ -4,7 +4,15 @@
    "cell_type": "code",
    "execution_count": 1,
    "metadata": {},
-   "outputs": [],
+   "outputs": [
+    {
+     "name": "stdout",
+     "output_type": "stream",
+     "text": [
+      "No module named 'deepmd'\n"
+     ]
+    }
+   ],
    "source": [
     "import os\n",
     "from mp_api.client import MPRester\n",
@@ -22,7 +30,7 @@
     "from prefect.futures import wait\n",
     "\n",
     "from mlip_arena.tasks.eos.run import fit as EOS\n",
-    "from mlip_arena.models.utils import REGISTRY, MLIPEnum\n",
+    "from mlip_arena.models import MLIPEnum\n",
     "\n",
     "load_dotenv()\n",
     "\n",

mlip_arena/tasks/thermal-conductivity/wte.csv

@@ -6,4 +6,3 @@ SevenNet,0.767
 ORBv2,1.732
 ORBv2(MPTrj),1.725
 eqV2(OMat-S),1.772
-eqV2(OMat),1.940