Publications of Yanggang Wang
All genres
Journal Article (4)
2022
Journal Article
Mazheika, A., Y. Wang, , , , L.M. Ghiringhelli, and M. Scheffler: Artificial-intelligence-driven discovery of catalyst genes with application to CO2 activation on semiconductor oxides. Nature Communications 13, 419 (2022).
2018
Journal Article
Y. Wang, , , , , and : Novel elastic, lattice dynamics and thermodynamic properties of metallic single-layer transition metal phosphides: 2H-M2P (Mo2P, W2P, Nb2P and Ta2P). Journal of Physics: Condensed Matter 30 (13), 135701 (2018).
, , 2017
Journal Article
Y. Wang and : Catalytic role of vacancy diffusion in ceria supported atomic gold catalyst. Chemical Communications 53 (65), 9125–9128 (2017).
,
Journal Article
Y. Wang, , , and : Structural Rearrangement of Au−Pd Nanoparticles under Reaction Conditions: An ab Initio Molecular Dynamics Study. ACS Nano 11 (2), 1649–1658 (2017).
, , Working Paper (1)
2019
Working Paper
Mazheika, A., Y. Wang, , L.M. Ghiringhelli, , , S.V. Levchenko and M. Scheffler: Ab initio data-analytics study of carbon-dioxide activation on semiconductor oxide surfaces., in press.