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material screening

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2 results in Keywords: material screening

Theoretical and Computational Chemistry

The importance of a charge transfer descriptor for the screening of electrocatalysts at the example of CO2 reduction.

Version 1 posted 29 April 2022

652

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Theoretical and Computational Chemistry

Compositionally-Restricted Attention-Based Network for Materials Property Prediction

Anthony Wang, Steven Kauwe, Ryan Murdock, Taylor Sparks

Version 3 posted 25 March 2021

2,195

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