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Theoretical and Computational Chemistry

(2)

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Working Paper

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Over 3 years

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Marivi Fernandez-Serra

2 results in Authors: Marivi Fernandez-Serra

Theoretical and Computational Chemistry

Learning from the Density to Correct Total Energy and Forces in First Principle Simulations

Sebastian Dick, Marivi Fernandez-Serra

Version 1 posted 06 August 2019

592

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Theoretical and Computational Chemistry

Machine Learning Accurate Exchange and Correlation Functionals of the Electronic Density

Sebastian Dick, Marivi Fernandez-Serra

Version 3 posted 18 June 2020

1,747

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