화학공학소재연구정보센터
검색결과 : 13건
No. Article
1 DFT study of Ni segregation at the B2-NiTi(110)/rutile-TiO2(110) interface
Juan J, Orazi V, Sandoval M, Bechthold P, Hernandez-Laguna A, Sainz-Diaz CI, Gonzalez EA, Jenko M, Jasen PV
Applied Surface Science, 489, 287, 2019
2 The role of Ga in the acetylene adsorption on PdGa intermetallic
Sandoval M, Bechthold P, Orazi V, Gonzalez EA, Juan A, Jasen PV
Applied Surface Science, 435, 568, 2018
3 The adsorption of CO, O-2 and H-2 on Li-doped defective (8,0) SWCNT: A DFT study
Luna CR, Bechthold P, Brizuela G, Juan A, Pistonesi C
Applied Surface Science, 459, 201, 2018
4 Hydrogen storage in Zr0.9Ti0.1(Ni0.5Cr0.5-xVx)(2) Laves phase, with x=0, 0.125, 0.25, 0.375, 0.5. A theoretical approach
Robina A, Bechthold P, Juan A, Pistonesi C, Pronsato ME
International Journal of Hydrogen Energy, 43(33), 16085, 2018
5 Rhodium clustering process on defective (8,0) SWCNT: Analysis of chemical and physical properties using density functional theory
Ambrusi RE, Luna CR, Sandoval MG, Bechthold P, Pronsato ME, Juan A
Applied Surface Science, 425, 823, 2017
6 DFT study of methanol adsorption on PtCo(111)
Orazi V, Bechthold P, Jasen PV, Faccio R, Pronsato ME, Gonzalez EA
Applied Surface Science, 420, 383, 2017
7 DFT study of CO adsorption on Pd-SnO2(110) surfaces
Bechthold P, Pronsato ME, Pistonesi C
Applied Surface Science, 347, 291, 2015
8 Electronic structure and soft magnetic properties of Se/FeSiAl (110) films
Schwindt VC, Ardenghi JS, Bechthold P, Juan A, Batic BS, Jenko M, Gonzalez EA, Jasen PV
Applied Surface Science, 354, 401, 2015
9 DFT study of benzene and CO co-adsorption on PtCo(111)
Orazi V, Ardenghi JS, Bechthold P, Jasen PV, Pronsato ME, Gonzalez EA
Applied Surface Science, 289, 502, 2014
10 Selenium adsorption at different coverages on Fe(100) and Fe(111): A DFT study
Schwindt VC, Ardenghi JS, Bechthold P, Gonzalez EA, Jasen PV, Juan A, Batic BS, Jenko M
Applied Surface Science, 315, 252, 2014