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Poul Georg Moses
Poul Georg Moses
Verified email at topsoe.dk
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Biomimetic hydrogen evolution: MoS2 nanoparticles as catalyst for hydrogen evolution
B Hinnemann, PG Moses, J Bonde, KP Jørgensen, JH Nielsen, S Horch, ...
Journal of the American Chemical Society 127 (15), 5308-5309, 2005
40142005
Electronic structure calculations with GPAW: a real-space implementation of the projector augmented-wave method
J Enkovaara, C Rostgaard, JJ Mortensen, J Chen, M Dułak, L Ferrighi, ...
Journal of physics: Condensed matter 22 (25), 253202, 2010
23172010
Scaling properties of adsorption energies for hydrogen-containing molecules on transition-metal surfaces
F Abild-Pedersen, JP Greeley, F Studt, J Rossmeisl, TR Fronczek-Munter, ...
Physical review letters 99 (1), 016105, 2007
15892007
Hydrogen evolution on nano-particulate transition metal sulfides
J Bonde, PG Moses, TF Jaramillo, JK Nørskov, I Chorkendorff
Faraday discussions 140, 219-231, 2009
8662009
A density functional for sparse matter
DC Langreth, BI Lundqvist, SD Chakarova-Käck, VR Cooper, M Dion, ...
Journal of Physics: Condensed Matter 21 (8), 084203, 2009
6362009
Location and coordination of promoter atoms in Co-and Ni-promoted MoS2-based hydrotreating catalysts
JV Lauritsen, J Kibsgaard, GH Olesen, PG Moses, B Hinnemann, ...
Journal of Catalysis 249 (2), 220-233, 2007
5482007
A consistent reaction scheme for the selective catalytic reduction of nitrogen oxides with ammonia
TVW Janssens, H Falsig, LF Lundegaard, PNR Vennestrøm, ...
ACS catalysis 5 (5), 2832-2845, 2015
4752015
Band bowing and band alignment in InGaN alloys
PG Moses, CG Van de Walle
Applied Physics Letters 96 (2), 2010
4292010
Scaling relationships for adsorption energies on transition metal oxide, sulfide, and nitride surfaces
EM Fernández, PG Moses, A Toftelund, HA Hansen, JI Martínez, ...
Angewandte Chemie International Edition 47 (25), 4683-4686, 2008
3842008
Recent STM, DFT and HAADF-STEM studies of sulfide-based hydrotreating catalysts: Insight into mechanistic, structural and particle size effects
F Besenbacher, M Brorson, BS Clausen, S Helveg, B Hinnemann, ...
Catalysis Today 130 (1), 86-96, 2008
3722008
Hybrid functional investigations of band gaps and band alignments for AlN, GaN, InN, and InGaN
PG Moses, M Miao, Q Yan, CG Van de Walle
The Journal of chemical physics 134 (8), 2011
3442011
The hydrogenation and direct desulfurization reaction pathway in thiophene hydrodesulfurization over MoS2 catalysts at realistic conditions: A density functional study
PG Moses, B Hinnemann, H Topsøe, JK Nørskov
Journal of Catalysis 248 (2), 188-203, 2007
3352007
Quantification of zinc atoms in a surface alloy on copper in an industrial‐type methanol synthesis catalyst
S Kuld, C Conradsen, PG Moses, I Chorkendorff, J Sehested
Angewandte Chemie International Edition 53 (23), 5941-5945, 2014
3072014
Methanol-to-hydrocarbons conversion: The alkene methylation pathway
RY Brogaard, R Henry, Y Schuurman, AJ Medford, PG Moses, P Beato, ...
Journal of catalysis 314, 159-169, 2014
1682014
The effect of Co-promotion on MoS2 catalysts for hydrodesulfurization of thiophene: A density functional study
PG Moses, B Hinnemann, H Topsøe, JK Nørskov
Journal of Catalysis 268 (2), 201-208, 2009
1642009
Visualizing the Stoichiometry of Industrial‐Style Co‐Mo‐S Catalysts with Single‐Atom Sensitivity
Y Zhu, QM Ramasse, M Brorson, PG Moses, LP Hansen, CF Kisielowski, ...
Angewandte Chemie International Edition 53 (40), 10723-10727, 2014
1452014
Density functional study of the adsorption and van der Waals binding of aromatic and conjugated compounds on the basal plane of MoS2
PG Moses, JJ Mortensen, BI Lundqvist, JK Nørskov
The Journal of chemical physics 130 (10), 2009
1272009
A complete reaction mechanism for standard and fast selective catalytic reduction of nitrogen oxides on low coverage VOx/TiO2 (0 0 1) catalysts
L Arnarson, H Falsig, SB Rasmussen, JV Lauritsen, PG Moses
Journal of catalysis 346, 188-197, 2017
1242017
A density functional study of inhibition of the HDS hydrogenation pathway by pyridine, benzene, and H2S on MoS2-based catalysts
Á Logadóttir, PG Moses, B Hinnemann, NY Topsøe, KG Knudsen, ...
Catalysis today 111 (1-2), 44-51, 2006
1182006
Ketene as a reaction intermediate in the carbonylation of dimethyl ether to methyl acetate over mordenite
DB Rasmussen, JM Christensen, B Temel, F Studt, PG Moses, ...
Angewandte Chemie International Edition 54 (25), 7261-7264, 2015
1172015
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