The structure and stability of reduced and oxidized mononuclear platinum species on nanostructured ceria from density functional modeling

H. A. Aleksandrov, K. M. Neyman, and G. N. Vayssilov, Phys. Chem. Chem. Phys. 17, 14551 (2015).

Stoichiometry engineering of ternary oxide ultrathin films: BaxTi2O3 on Au(111)

C. Wu, M. R. Castell, J. Goniakowski, and C. Noguera, Phys. Rev. B 91, 155424 (2015).

Characterization of thin CeO2 films electrochemically deposited on HOPG

F. Faisal, A. Toghan, I. Khalakhan, M. Vorokhta, V. Matolin, and J. Libuda, Appl. Surf. Sci. 350, 142 (2015).

Promoted ceria catalysts for alkyne semi-hydrogenation

G. Vile, P. Dähler, J. Vecchietti, M. A. Baltanás, S. Collins, M. Calatayud, A. Bonivardi, J. Perez-Ramirez, J. Catal. 324, 69 (2015).

First principles modeling of electron tunneling between defects in m-HfO2

K. P. McKenna and J. Blumberger, Microel. Eng. 147, 235 (2015).

The non-innocent role of cerium oxide in heterogeneous catalysis: A theoretical perspective

M. V. Ganduglia-Pirovano, Catal. Today 253, 20 (2015).

Stabilization of Ultrathin Zinc Oxide Films on Metals: Reconstruction versus Hydroxylation

B.-H. Liu, J. A. Boscoboinik, Y. Cui, S. Shaikhutdinov, and H.-J. Freund, J. Phys. Chem. C 119, 7842 (2015).

Electronic structure and phase stability of oxide semiconductors: Performance of dielectric-dependent hybrid functional DFT, benchmarked against GW band structure calculations and experiments

M. Gerosa, C. E. Bottani, L. Caramella, G. Onida, C. Di Valentin, and G. Pacchioni, Phys. Rev. B 91, 155201 (2015).

Bimetallic Co–Fe and Co–Cr oxide systems supported on CeO2: Characterization and CO oxidation catalytic behaviour

K. Rida, A. López Cámara, M. A. Peña, C. L. Bolívar-Díaz, and A. Martínez-Arias, Int. Journ. Hydr. En. 40, 11267 (2015).

TIR and density functional study of NO interaction with reduced ceria: Identification of N3− and NO2− as new intermediates in NO conversion

M. Y. Mihaylov, E. Z. Ivanova, H. A. Aleksandrov, P. S. Petkov, G. N. Vayssilov, and K. I. Hadjiivanov, Appl. Catal. B: Environ. 176–177, 107 (2015).