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https://github.com/ofir-frd/predict-minerals-structure-from-materials-characteristics

Predict materials structures from a list of of 3112 minerals, their chemical composition and properties
https://github.com/ofir-frd/predict-minerals-structure-from-materials-characteristics

data-science decision-tree knn-classifier machine-learning materials-science

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Predict materials structures from a list of of 3112 minerals, their chemical composition and properties

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README

        

# Predict Minerals Structure From Materials Characteristics

A Kaggle dataset.

Predict materials structures from a list of 3112 minerals, their chemical composition, and properties.

## About Data Collection Methodology

Data was collected from Wikipedia (https://en.wikipedia.org/wiki/List_of_minerals), The American Mineralogist Crystal Structure Database (http://rruff.geo.arizona.edu/AMS/amcsd.php), and the gemology project website (http://gemologyproject.com/wiki).

### Description of The Data

Directory description:

```

Root Dir/
- minerals-structure-from-materials-characteristics.ipynb
- Minerals_Database.csv
- README.md
- LICENSE.md
- .gitignore

```

Features review:

```
Minerals_Database.csv/
- Labels
- Crystal Structure
- Numerical
- Mohs Hardness
- Diaphaneity
- Specific Gravity
- Optical
- Refractive Index
- count
- Molar Mass
- Molar Volume
- Calculated Density
- 118 features: sum of atoms per molucule in the periodic table

```

### File Formats

Code is written in Python on Jupyter '.ipynb'.

The data provided in this project is a '.csv' file with no separation between train and test datasets.

```
-50,000 3112 minerals, their chemical composition, and properties, format csv.
```

## Online Repository Link

* [Data Repository](https://www.kaggle.com/vinven7/comprehensive-database-of-minerals)

## Author

* [ofir-frd](https://github.com/ofir-frd)

## License

This project is licensed under the Apache License 2.0 - see the [LICENSE.md](https://github.com/ofir-frd/Comprehensive_database_of_Minerals/blob/main/LICENSE) file for details

## Acknowledgments

* [Vineeth Venugopal](https://www.linkedin.com/in/vineeth-venugopal-959781108/), who collected and organized the data, and create the dataset in Kaggle