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How to verify the precision of density-functional-theory implementations via reproducible and universal workflows
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Towards accurate processing-structure-property links using deep learning
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The Abinit project : impact, environment and recent developments
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- Journal Article
- A1
- open access
A first-principles reassessment of the Fe-N phase diagram in the low-nitrogen limit
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- Journal Article
- A1
- open access
Optical properties of isolated and covalent organic framework-embedded ruthenium complexes