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Organization
Speakers
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Schedule
Day by Day
Practical Information
Registration
Abstract Submission
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Discover Brussels
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Theory
Exact KS-DFT Diatomic Exchange Energy Contributions for Interacting Quantum Atoms Analysis
July 20, 2022
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Electronegativity Equalization: New Tools for an Old Problem
July 20, 2022
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Generalising Conceptual DFT to Include the Effect of Strong Magnetic Fields
July 20, 2022
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Chemical Accuracy at Low Computational Cost with s-Functionals for the Kohn-Sham Correlation Energy
July 20, 2022
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Spin-Current DFT for Spin-Orbit Coupling in Materials
July 20, 2022
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First-Principles Hund’s J: a Promising yet Intriguing Low-Cost Generalised Kohn-Sham Band-Gap Correction Device
July 19, 2022
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A New Generation of Kinetic Functionals Based on the Yukawa Potential Kernel
July 19, 2022
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Locally Range-Separated Local Hybrid Functionals – The Next Level on the Hybrid Functional Ladder
July 19, 2022
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Quantum Hydrodynamic Theory with Laplacian-Level Kinetic Energy Functionals
July 19, 2022
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Correlation Functionals from the Møller-Plesset Adiabatic Connection: an Accurate Description of Noncovalent Interactions
July 19, 2022
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