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Browsing by Author de Gironcoli, Stefano
Showing results 1 to 7 of 7
| Issue Date | Title | Author(s) |
| 2002-02-01 | Ab initio calculation of the thermal properties of Cu: Performance of the LDA and GGA | Narasimhan, Shobhana; de Gironcoli, Stefano |
| 2009-04 | Effective coordination as a predictor of adsorption energies: A model study of NO on Rh(100) and Rh/MgO(100) surfaces | Pushpa, Raghani; Ghosh, Prasenjit; Narasimhan, Shobhana; de Gironcoli, Stefano |
| 2009-12 | Effective coordination number: A simple indicator of activation energies for NO dissociation on Rh(100) surfaces | Ghosh, Prasenjit; Pushpa, Raghani; de Gironcoli, Stefano; Narasimhan, Shobhana |
| 2008-05-12 | Interplay between bonding and magnetism in the binding of NO to Rh clusters | Ghosh, Prasenjit; Pushpa, Raghani; de Gironcoli, Stefano; Narasimhan, Shobhana |
| 2008-05-12 | Interplay between bonding and magnetism in the binding of NO to Rh clusters | Ghosh, Prasenjit; Pushpa, Raghani; de Gironcoli, Stefano; Narasimhan, Shobhana |
| 2015 | Substrate doping: A strategy for enhancing reactivity on gold nanocatalysts by tuning sp bands | Mammen, Nisha; de Gironcoli, Stefano; Narasimhan, Shobhana |
| 2011-03-09 | Tuning the Morphology of Gold Clusters by Substrate Doping | Mammen, Nisha; Narasimhan, Shobhana; de Gironcoli, Stefano |
