| P2093 | author name string | Michael J Janik | |
| | Adam D Mayernick | |
| P2860 | cites work | BaCe1-xPdxO3-δ(0 ≤x≤ 0.1): Redox Controlled Ingress and Egress of Palladium in a Perovskite | Q59261200 |
| | From ultrasoft pseudopotentials to the projector augmented-wave method | Q21708488 |
| | Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set | Q26778418 |
| | Special points for Brillouin-zone integrations | Q26778424 |
| | Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set | Q26778473 |
| | Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation | Q27342464 |
| | Modeling doped and defective oxides in catalysis with density functional theory methods: room for improvements | Q43868886 |
| | Oxygen vacancy formation energy in Pd-doped ceria: a DFT+U study. | Q50927878 |
| | Effects of Zr doping on stoichiometric and reduced ceria: a first-principles study. | Q51177430 |
| | Direct hydrocarbon solid oxide fuel cells. | Q51549472 |
| | CeO2 catalysed conversion of CO, NO2 and NO from first principles energetics. | Q51950571 |
| | Effects of Pd Particle Size and Ceria Loading on NO Reduction with CO | Q56953270 |
| | Nano-assembled Pd catalysts on MgO thin films | Q57783994 |
| P433 | issue | 8 | |
| P407 | language of work or name | English | Q1860 |
| P304 | page(s) | 084701 | |
| P577 | publication date | 2009-08-01 | |
| P1433 | published in | Journal of Chemical Physics | Q900472 |
| P1476 | title | Ab initio thermodynamic evaluation of Pd atom interaction with CeO(2) surfaces. | |
| P478 | volume | 131 | |