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Reviews in Computational Chemistry; John Wiley & Sons, Ltd, 2017; Chapter 3, pp 93--149

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The vDZP Basis Set Is Effective For Many Density Functionals

physics.chem-ph · 2024-11-20 · conditional · novelty 6.0

The vDZP basis set, originally built for the ωB97X-3c composite method, also yields accurate and fast DFT results with B97-D3BJ, r2SCAN-D4, B3LYP-D4, M06-2X, and ωB97X-D4 without reparameterization.

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  • The vDZP Basis Set Is Effective For Many Density Functionals physics.chem-ph · 2024-11-20 · conditional · none · ref 1

    The vDZP basis set, originally built for the ωB97X-3c composite method, also yields accurate and fast DFT results with B97-D3BJ, r2SCAN-D4, B3LYP-D4, M06-2X, and ωB97X-D4 without reparameterization.