Add wb97x-D to NAGL2 timing benchmark #625

	name: Dataset Validation

	on:
	pull_request:
	branches:
	- master
	paths:
	- 'submissions/*/dataset.json*'
	- 'submissions/*/compute.json*'

	defaults:
	run:
	shell: bash -l {0}

	jobs:
	dataset_validation:
	runs-on: ubuntu-latest
	steps:
	- name: Checkout code
	uses: nschloe/action-cached-lfs-checkout@v1

	- name: Additional info about the build
	run: \|
	uname -a
	df -h
	ulimit -a

	- name: Install environment
	uses: mamba-org/setup-micromamba@v1
	with:
	environment-file: devtools/conda-envs/validation.yaml
	create-args: >-
	python=3.11
	cache-environment: true

	- name: Environment Information
	run: \|
	conda info
	conda list

	- id: file_changes
	uses: trilom/[email protected]

	- name: Validate Dataset
	env: # Or as an environment variable
	GH_TOKEN: ${{ secrets.GH_DANGERBOT_TOKEN_LIMITED}}
	run: \|
	python ./management/validation.py '${{ steps.file_changes.outputs.files}}' '${{ github.event.number }}'

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