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Ab initio design of Ca-decorated organic frameworks for high capacity molecular hydrogen storage with enhanced binding Sun, YY; Lee, K; Kim, Yong-Hyun; Zhang, SB, APPLIED PHYSICS LETTERS, v.95, no.3, 2009-07 |
Accuracy of density functional theory methods for weakly bonded systems: The case of dihydrogen binding on metal centers Sun, YY; Lee, K; Wang, L; Kim, Yong-Hyun; Chen, W; Chen, ZF; Zhang, SB, PHYSICAL REVIEW B, v.82, no.7, 2010-08 |
Comment on "Inaccuracy of Density Functional Theory Calculations for Dihydrogen Binding Energetics onto Ca Cation Centers" Ohk, Y; Kim, Yong-Hyun; Jung, Yousung, PHYSICAL REVIEW LETTERS, v.104, no.17, 2010-04 |
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