| 1 |
D-pi-A dye attached on TiO2 (101) and TiO2 (001) surfaces: Electron transfer properties from ab initio calculations
Orellana W
Solar Energy, 216, 266, 2021 |
| 2 |
Influence of oxide support on Pd properties: A gain for O diffusion versus minor impact for CH4 dissociation
Rybakov AA, Bryukhanov IA, Larin AV, Todorova S, Vercauteren DP, Zhidomirov GM
Catalysis Today, 357, 368, 2020 |
| 3 |
Unusual adsorption behavior of hydrogen molecules on Zr-doped perfect and oxygen-vacancy defective rutile TiO2(110) surfaces: Periodic DFT study
Panta R, Ruangpornvisuti V
International Journal of Hydrogen Energy, 44(60), 32101, 2019 |
| 4 |
Adsorption of hydrogen and hydrogen-containing gases on Pd- and Ag-single atoms doped on anatase TiO2 (101) surfaces and their sensing performance
Panta R, Nanthamathee C, Ruangpornvisuti V
Applied Surface Science, 450, 112, 2018 |
| 5 |
Investigation of CHx (x=2-4) Adsorption on Mo2C and Mo4C2 Sites Incorporated in ZSM-5 Zeolite Using Periodic-DFT Approach
Shetty S, Sivakumar S, Jana SK, Sreenivasarao G
Catalysis Letters, 148(1), 68, 2018 |
| 6 |
Adsorption of hydrogen molecule on noble metal doped on oxygen-vacancy defect of anatase TiO2(101) surface: Periodic DFT study
Panta R, Ruangpornvisuti V
International Journal of Hydrogen Energy, 42(30), 19106, 2017 |
| 7 |
Mechanisms of removal of three widespread pharmaceuticals by two clay materials
Dordio AV, Miranda S, Ramalho JPP, Carvalho AJP
Journal of Hazardous Materials, 323, 575, 2017 |
| 8 |
Control of crystallite and particle size in the synthesis of layered double hydroxides: Macromolecular insights and a complementary modeling tool
Galvao TLP, Neves CS, Caetano APF, Maia F, Mata D, Malheiro E, Ferreira MJ, Bastos AC, Salak AN, Gomes JRB, Tedim J, Ferreira MGS
Journal of Colloid and Interface Science, 468, 86, 2016 |
| 9 |
A theoretical view of 1,3-butadiene selective hydrogenation toward cis-2-butene on Pd-Ni layered catalyst
Gomez G, Belelli PG, Cabeza GF, Castellani NJ
Applied Surface Science, 353, 820, 2015 |
| 10 |
Periodic DFT investigation of methanol coverage on surfaces of MgCl2-supported Ziegler-Natta catalysts
Xie KF, Huang AP, Zhu BC, Xu JC, Liu P
Applied Surface Science, 356, 967, 2015 |
