I agree that this site is using cookies. You can find further informations here.
X
Willock, David J.
174  results:
Search for persons X
?
1

A computational study of the structure of anion vacancy def..:

Hoh, Soon W. ; Jones, Glenn ; Willock, David J.
Catalysis Today.  442 (2024)  - p. 114946 , 2024
Link: https://doi.org/10.1016/..
 
?
2

Ruthenium ion catalysed C–C bond activation in lignin model..:

Guadix-Montero, Susana ; Sainna, Mala A. ; Jin, Jiangpeiyun...
Catalysis Science & Technology.  13 (2023)  20 - p. 5912-5923 , 2023
Link: https://doi.org/10.1039/..
 
?
3

A DFT study of the catalytic ODH of n-hexane over a cluster..:

Damoyi, Nkululeko E. ; Friedrich, Holger B. ; Kruger, Gert H..
Molecular Catalysis.  541 (2023)  - p. 113078 , 2023
Link: https://doi.org/10.1016/..
 
?
4

The selective oxidation of methane to methanol using in sit..:

Carter, James H. ; Lewis, Richard J. ; Demetriou, Nikolas...
Catalysis Science & Technology.  13 (2023)  20 - p. 5848-5858 , 2023
Link: https://doi.org/10.1039/..
 
?
5

Transfer hydrogenation of methyl levulinate with methanol t..:

Douthwaite, Mark ; Zhang, Bin ; Iqbal, Sarwat...
Catalysis Communications.  164 (2022)  - p. 106430 , 2022
Link: https://doi.org/10.1016/..
 
?
6

Au-ZSM-5 catalyses the selective oxidation of CH4 to CH3OH ..:

Qi, Guodong ; Davies, Thomas E. ; Nasrallah, Ali...
Nature Catalysis.  5 (2022)  1 - p. 45-54 , 2022
Link: https://doi.org/10.1038/..
 
?
7

Materials and Molecular Modeling at the Exascale:

Keal, Thomas W. ; Elena, Alin-Marin ; Sokol, Alexey A....
Computing in Science & Engineering.  24 (2022)  1 - p. 36-45 , 2022
Link: https://doi.org/10.1109/..
 
?
8

Band gap engineering of amine functionalized Ag(I)-based co..:

Mandal, Subrata ; Nanavati, Sachin P. ; Willock, David J..
Applied Catalysis B: Environmental.  303 (2022)  - p. 120821 , 2022
Link: https://doi.org/10.1016/..
 
?
9

Methane Oxidation to Methanol:

Dummer, Nicholas F. ; Willock, David J. ; He, Qian...
Chemical Reviews.  123 (2022)  9 - p. 6359-6411 , 2022
Link: https://doi.org/10.1021/..
 
?
10

Recent Advances on the Valorization of Glycerol into Alcoho..:

Smith, Louise R. ; Douthwaite, Mark ; Mugford, Karl...
Energies.  15 (2022)  17 - p. 6250 , 2022
Link: https://doi.org/10.3390/..
 
?
11

Density Functional Theory Study of the Partial Oxidation of..:

Nasrallah, Ali ; Engel, Julien ; A Catlow, C. Richard.
The Journal of Physical Chemistry C.  125 (2021)  34 - p. 18770-18785 , 2021
Link: https://doi.org/10.1021/..
 
?
12

A combined periodic DFT and QM/MM approach to understand th..:

Sainna, Mala A. ; Nanavati, Sachin ; Black, Constance...
Faraday Discussions.  229 (2021)  - p. 108-130 , 2021
Link: https://doi.org/10.1039/..
 
?
13

Controlled reduction of aromaticity of alkylated polyaromat..:

Nowicka, Ewa ; Sankar, Meenakshisundaram ; Jenkins, Robert L....
New Journal of Chemistry.  45 (2021)  31 - p. 13885-13892 , 2021
Link: https://doi.org/10.1039/..
 
?
14

Gas Phase Glycerol Valorization over Ceria Nanostructures w..:

Smith, Louise R. ; Sainna, Mala A. ; Douthwaite, Mark...
ACS Catalysis.  11 (2021)  8 - p. 4893-4907 , 2021
Link: https://doi.org/10.1021/..
 
?
15

The interaction of CO with a copper(ii) chloride oxy-chlori..:

Guan, Shaoliang ; Rossi, Giovanni E. ; Winfield, John M....
Faraday Discussions.  229 (2021)  - p. 318-340 , 2021
Link: https://doi.org/10.1039/..
 
1-15