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Influence of the complete basis set approximation, tight weighted-core, and diffuse functions on the DLPNO-CCSD(T1) atomization energies of neutral H,C,O-compounds

Yury Minenkov, Luigi Cavallo, Kirk A. Peterson. Influence of the complete basis set approximation, tight weighted-core, and diffuse functions on the DLPNO-CCSD(T1) atomization energies of neutral H,C,O-compounds. Journal of Computational Chemistry, 44(5):687-696, February 2023. [doi]

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