Upload dataset

README.md

@@ -106,6 +106,59 @@ dataset_info:
     num_examples: 26391
   download_size: 133682469
   dataset_size: 401504000
+- config_name: gvrh
+  features:
+  - name: mbid
+    dtype: string
+  - name: cif_p1
+    dtype: string
+  - name: cif_symmetrized
+    dtype: string
+  - name: zmatrix
+    dtype: string
+  - name: atom_sequences
+    dtype: string
+  - name: atom_sequences_plusplus
+    dtype: string
+  - name: local_env
+    dtype: string
+  - name: composition
+    dtype: string
+  - name: slices
+    dtype: string
+  - name: crystal_text_llm
+    dtype: string
+  - name: composition_energy
+    dtype: float64
+  - name: geometry_energy
+    dtype: float64
+  - name: composition_energy_normalized
+    dtype: float64
+  - name: geometry_energy_normalized
+    dtype: float64
+  - name: total_energy_alpha_0
+    dtype: float64
+  - name: total_energy_alpha_0.2
+    dtype: float64
+  - name: total_energy_alpha_0.4
+    dtype: float64
+  - name: total_energy_alpha_0.5
+    dtype: float64
+  - name: total_energy_alpha_0.6
+    dtype: float64
+  - name: total_energy_alpha_0.8
+    dtype: float64
+  - name: total_energy_alpha_1
+    dtype: float64
+  splits:
+  - name: train
+    num_bytes: 13832071
+    num_examples: 4480
+  - name: test
+    num_bytes: 4699722
+    num_examples: 1528
+  download_size: 6082860
+  dataset_size: 18531793
 - config_name: jdft2d
   features:
   - name: mbid
@@ -278,6 +331,12 @@ configs:
     path: formenergy/train-*
   - split: test
     path: formenergy/test-*
+- config_name: gvrh
+  data_files:
+  - split: train
+    path: gvrh/train-*
+  - split: test
+    path: gvrh/test-*
 - config_name: jdft2d
   data_files:
   - split: train

gvrh/test-00000-of-00001.parquet

@@ -0,0 +1,3 @@
+version https://git-lfs.github.com/spec/v1
+oid sha256:bf772ab8d1e7ed2c9cea15068f331a602a718bbf35ae8172d03bb9b2050fc49c
+size 1581702

gvrh/train-00000-of-00001.parquet

@@ -0,0 +1,3 @@
+version https://git-lfs.github.com/spec/v1
+oid sha256:cb1a35458bffad55e8dd8809d60fa783b87c256310ddd03e63994e0399f50412
+size 4501158