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Nd0.25Ca0.125La0.625Ti0.25Sc0.125Nb0.625O3
Nd0.25Ca0.125La0.625Ti0.5Sc0.125Nb0.375O3
Nd0.25Ca0.125La0.625Ti0.25Sc0.125Mo0.625O3
Nd0.25Ca0.125La0.625Ti0.5Sc0.125Mo0.375O3
Nd0.25Ca0.125La0.625Ti0.25Sc0.125Ta0.625O3
Nd0.25Ca0.125La0.625Ti0.5Sc0.125Ta0.375O3
Nd0.25Ca0.125La0.625Ti0.25Y0.125Sc0.625O3
Nd0.25Ca0.125La0.625Ti0.5Y0.125Sc0.375O3
Nd0.25Ca0.125La0.625Ti0.25Y0.125Ce0.625O3
Nd0.25Ca0.125La0.625Ti0.5Y0.125Ce0.375O3
Nd0.25Ca0.125La0.625Ti0.125Y0.125Ti0.75O3
Nd0.25Ca0.125La0.625Ti0.25Y0.125Fe0.625O3
Nd0.25Ca0.125La0.625Ti0.5Y0.125Fe0.375O3
Nd0.25Ca0.125La0.625Ti0.25Y0.125Co0.625O3
Nd0.25Ca0.125La0.625Ti0.5Y0.125Co0.375O3
Nd0.25Ca0.125La0.625Ti0.25Y0.125Ni0.625O3
Nd0.25Ca0.125La0.625Ti0.5Y0.125Ni0.375O3
Nd0.25Ca0.125La0.625Ti0.25Y0.125Cu0.625O3
Nd0.25Ca0.125La0.625Ti0.5Y0.125Cu0.375O3
Nd0.25Ca0.125La0.625Ti0.25Y0.125Sn0.625O3
Nd0.25Ca0.125La0.625Ti0.5Y0.125Sn0.375O3
Nd0.25Ca0.125La0.625Ti0.25Y0.125Zr0.625O3
Nd0.25Ca0.125La0.625Ti0.5Y0.125Zr0.375O3
Nd0.25Ca0.125La0.625Ti0.25Y0.125Nb0.625O3
Nd0.25Ca0.125La0.625Ti0.5Y0.125Nb0.375O3
Nd0.25Ca0.125La0.625Ti0.25Y0.125Mo0.625O3
Nd0.25Ca0.125La0.625Ti0.5Y0.125Mo0.375O3
Nd0.25Ca0.125La0.625Ti0.25Y0.125Ta0.625O3
Nd0.25Ca0.125La0.625Ti0.5Y0.125Ta0.375O3
Nd0.25Ca0.125La0.625Ti0.25Ce0.125Sc0.625O3
Nd0.25Ca0.125La0.625Ti0.5Ce0.125Sc0.375O3
Nd0.25Ca0.125La0.625Ti0.25Ce0.125Y0.625O3
Nd0.25Ca0.125La0.625Ti0.5Ce0.125Y0.375O3
Nd0.25Ca0.125La0.625Ti0.125Ce0.125Ti0.75O3
Nd0.25Ca0.125La0.625Ti0.25Ce0.125Fe0.625O3
Nd0.25Ca0.125La0.625Ti0.5Ce0.125Fe0.375O3
Nd0.25Ca0.125La0.625Ti0.25Ce0.125Co0.625O3
Nd0.25Ca0.125La0.625Ti0.5Ce0.125Co0.375O3
Nd0.25Ca0.125La0.625Ti0.25Ce0.125Ni0.625O3
Nd0.25Ca0.125La0.625Ti0.5Ce0.125Ni0.375O3
Nd0.25Ca0.125La0.625Ti0.25Ce0.125Cu0.625O3
Nd0.25Ca0.125La0.625Ti0.5Ce0.125Cu0.375O3
Nd0.25Ca0.125La0.625Ti0.25Ce0.125Sn0.625O3
Nd0.25Ca0.125La0.625Ti0.5Ce0.125Sn0.375O3
Nd0.25Ca0.125La0.625Ti0.25Ce0.125Zr0.625O3
Nd0.25Ca0.125La0.625Ti0.5Ce0.125Zr0.375O3
Nd0.25Ca0.125La0.625Ti0.25Ce0.125Nb0.625O3
Nd0.25Ca0.125La0.625Ti0.5Ce0.125Nb0.375O3
Nd0.25Ca0.125La0.625Ti0.25Ce0.125Mo0.625O3
Nd0.25Ca0.125La0.625Ti0.5Ce0.125Mo0.375O3
Nd0.25Ca0.125La0.625Ti0.25Ce0.125Ta0.625O3
Nd0.25Ca0.125La0.625Ti0.5Ce0.125Ta0.375O3
Nd0.25Ca0.125La0.625Ti0.125Fe0.125Sc0.75O3
Nd0.25Ca0.125La0.625Ti0.25Fe0.125Sc0.625O3
Nd0.25Ca0.125La0.625Ti0.5Fe0.125Sc0.375O3
Nd0.25Ca0.125La0.625Ti0.125Fe0.125Y0.75O3
Nd0.25Ca0.125La0.625Ti0.25Fe0.125Y0.625O3
Nd0.25Ca0.125La0.625Ti0.5Fe0.125Y0.375O3
Nd0.25Ca0.125La0.625Ti0.125Fe0.125Ce0.75O3
Nd0.25Ca0.125La0.625Ti0.25Fe0.125Ce0.625O3
Nd0.25Ca0.125La0.625Ti0.5Fe0.125Ce0.375O3
Nd0.25Ca0.125La0.625Ti0.125Fe0.125Ti0.75O3
Nd0.25Ca0.125La0.625Ti0.125Fe0.125Co0.75O3
Nd0.25Ca0.125La0.625Ti0.25Fe0.125Co0.625O3
Nd0.25Ca0.125La0.625Ti0.5Fe0.125Co0.375O3
Nd0.25Ca0.125La0.625Ti0.125Fe0.125Ni0.75O3
Nd0.25Ca0.125La0.625Ti0.25Fe0.125Ni0.625O3
Nd0.25Ca0.125La0.625Ti0.5Fe0.125Ni0.375O3
Nd0.25Ca0.125La0.625Ti0.125Fe0.125Cu0.75O3
Nd0.25Ca0.125La0.625Ti0.25Fe0.125Cu0.625O3
Nd0.25Ca0.125La0.625Ti0.5Fe0.125Cu0.375O3
Nd0.25Ca0.125La0.625Ti0.125Fe0.125Sn0.75O3
Nd0.25Ca0.125La0.625Ti0.25Fe0.125Sn0.625O3
Nd0.25Ca0.125La0.625Ti0.5Fe0.125Sn0.375O3
Nd0.25Ca0.125La0.625Ti0.125Fe0.125Zr0.75O3
Nd0.25Ca0.125La0.625Ti0.25Fe0.125Zr0.625O3
Nd0.25Ca0.125La0.625Ti0.5Fe0.125Zr0.375O3
Nd0.25Ca0.125La0.625Ti0.125Fe0.125Nb0.75O3
Nd0.25Ca0.125La0.625Ti0.25Fe0.125Nb0.625O3
Nd0.25Ca0.125La0.625Ti0.5Fe0.125Nb0.375O3
Nd0.25Ca0.125La0.625Ti0.125Fe0.125Mo0.75O3
Nd0.25Ca0.125La0.625Ti0.25Fe0.125Mo0.625O3
Nd0.25Ca0.125La0.625Ti0.5Fe0.125Mo0.375O3
Nd0.25Ca0.125La0.625Ti0.125Fe0.125Ta0.75O3
Nd0.25Ca0.125La0.625Ti0.25Fe0.125Ta0.625O3
Nd0.25Ca0.125La0.625Ti0.5Fe0.125Ta0.375O3
Nd0.25Ca0.125La0.625Ti0.125Co0.125Sc0.75O3
Nd0.25Ca0.125La0.625Ti0.25Co0.125Sc0.625O3
Nd0.25Ca0.125La0.625Ti0.5Co0.125Sc0.375O3
Nd0.25Ca0.125La0.625Ti0.125Co0.125Y0.75O3
Nd0.25Ca0.125La0.625Ti0.25Co0.125Y0.625O3
Nd0.25Ca0.125La0.625Ti0.5Co0.125Y0.375O3
Nd0.25Ca0.125La0.625Ti0.125Co0.125Ce0.75O3
Nd0.25Ca0.125La0.625Ti0.25Co0.125Ce0.625O3
Nd0.25Ca0.125La0.625Ti0.5Co0.125Ce0.375O3
Nd0.25Ca0.125La0.625Ti0.125Co0.125Ti0.75O3
Nd0.25Ca0.125La0.625Ti0.125Co0.125Fe0.75O3
Nd0.25Ca0.125La0.625Ti0.25Co0.125Fe0.625O3
Nd0.25Ca0.125La0.625Ti0.5Co0.125Fe0.375O3
Nd0.25Ca0.125La0.625Ti0.125Co0.125Ni0.75O3
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Candidate perovskite compositions from "Machine Learning Materials Properties with Accurate Predictions, Uncertainty Estimates, Domain Guidance, and Persistent Online Accessibility" by Jacobs et al

Dataset Information

Fields

Field Role Description Units
Composition input Perovskite composition strings, e.g. Sr0.5Bi0.125P

Splits

  • test: test

Usage

With Foundry-ML (recommended for materials science workflows)

from foundry import Foundry

f = Foundry()
dataset = f.get_dataset("10.18126/acd8-rj94")
X, y = dataset.get_as_dict()['train']

With HuggingFace Datasets

from datasets import load_dataset

dataset = load_dataset("cac7b605-bd94-4657-ad62-bfceab05f0ce")

Citation

@misc{https://doi.org/10.18126/acd8-rj94
doi = {10.18126/acd8-rj94}
url = {https://doi.org/10.18126/acd8-rj94}
author = {Engler, Will}
title = {Candidate perovskite compositions from "Machine Learning Materials Properties with Accurate Predictions, Uncertainty Estimates, Domain Guidance, and Persistent Online Accessibility" by Jacobs et al}
keywords = {machine learning, foundry, materials science}
publisher = {Materials Data Facility}
year = {root=2024}}

License

other


This dataset was exported from Foundry-ML, a platform for materials science datasets.

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