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• W2017663485 endingPage "1513" @default.
• W2017663485 startingPage "1503" @default.
• W2017663485 abstract "The Tkatchenko–Scheffler vdW-TS method [Phys. Rev. Lett.2009, 102, 073005] has been implemented in a plane-wave DFT code and used to characterize several dispersion-dominated systems, including layered materials, noble-gas solids, and molecular crystals. Full optimizations of the structures, including relaxation of the stresses on the unit cells, were carried out. Internal geometrical parameters, lattice constants, bulk moduli, and cohesive energies are reported and compared to experimental results." @default.
• W2017663485 created "2016-06-24" @default.
• W2017663485 creator A5000789999 @default.
• W2017663485 creator A5019158207 @default.
• W2017663485 creator A5033977455 @default.
• W2017663485 date "2012-03-27" @default.
• W2017663485 modified "2023-10-05" @default.
• W2017663485 title "An Assessment of the vdW-TS Method for Extended Systems" @default.
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• W2017663485 doi "https://doi.org/10.1021/ct200618b" @default.
• W2017663485 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/26596760" @default.
• W2017663485 hasPublicationYear "2012" @default.
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