RT @owl_posting: molecular vs periodic systems: https://t.co/IHvVoGmlCL the achievement of accurate water simulation (if you care about on…
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RT @owl_posting: molecular vs periodic systems: https://t.co/IHvVoGmlCL the achievement of accurate water simulation (if you care about on…
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molecular vs periodic systems: https://t.co/IHvVoGmlCL the achievement of accurate water simulation (if you care about only modeling water and nothing else): https://t.co/lWV5Ei3xmb
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@JGBrandenburg Somewhat surprising to see that the B97M-V functionals, which possibly provide the most reasonable #DFT representation of #water, are missing from this analysis. For #compchem details: https://t.co/FAlenObuAh https://t.co/j2DsRhcBU3 https…