Energetics of (H2O)20 isomers by means of F12 canonical and localized coupled cluster methods
Author:
Publisher
AIP Publishing
Link
http://aip.scitation.org/doi/pdf/10.1063/5.0049720
Reference55 articles.
1. Stabilization and Structure Calculations for Noncovalent Interactions in Extended Molecular Systems Based on Wave Function and Density Functional Theories
2. Benchmark Calculations of Interaction Energies in Noncovalent Complexes and Their Applications
3. The X40×10 Halogen Bonding Benchmark Revisited: Surprising Importance of (n–1)d Subvalence Correlation
4. Water: From Clusters to the Bulk
5. On the accuracy of the MB-pol many-body potential for water: Interaction energies, vibrational frequencies, and classical thermodynamic and dynamical properties from clusters to liquid water and ice
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1. Performance of Localized-Orbital Coupled-Cluster Approaches for the Conformational Energies of Longer n-Alkane Chains;The Journal of Physical Chemistry A;2022-12-12
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3. S66 noncovalent interactions benchmark re-examined: Composite localized coupled cluster approaches;INTERNATIONAL CONFERENCE OF COMPUTATIONAL METHODS IN SCIENCES AND ENGINEERING ICCMSE 2021;2022
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