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9 works

Work: Density-functional thermochemistry. I. The effect of the exchange-only gradient correction

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  7. DFT study of pure and Pt-decorated BN nanocone as a nanocarrier for nitrosourea anticancer drug

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  8. Uncovering the potential of two-dimensional T-BC monolayer as anode for Ca-ion batteries: A computer-based study and electrochemical properties

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  9. Employing Ti-doped BN nanocone for the drug delivery of hydroxyurea anticancer: outlook of DFT calculations

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