-
1
-
-
0242635993
-
Hydrogenation on metal surfaces: why are nanoparticles more active than single crystals?
-
Int. Ed.
-
A.M. Doyle, S.K. Shaikhutdinov, S.D. Jackson, H.-J. Freund, Hydrogenation on metal surfaces: why are nanoparticles more active than single crystals? Angew. Chem., Int. Ed. 42 (2003) 5240.
-
(2003)
Angew. Chem.
, vol.42
, pp. 5240
-
-
Doyle, A.M.1
Shaikhutdinov, S.K.2
Jackson, S.D.3
Freund, H.-J.4
-
2
-
-
0041885498
-
2 over palladium catalysts
-
2 over palladium catalysts. J. Catal. 2003, 216:455-460.
-
(2003)
J. Catal.
, vol.216
, pp. 455-460
-
-
Lunsford, J.H.1
-
3
-
-
33745423097
-
Elucidation of the electrochemical activation of water over Pd by first principles
-
Int. Ed.
-
J.S. Filhol, M. Neurock, Elucidation of the electrochemical activation of water over Pd by first principles, Angew. Chem., Int. Ed. 418 (2006) 416-420.
-
(2006)
Angew. Chem.
, vol.418
, pp. 416-420
-
-
Filhol, J.S.1
Neurock, M.2
-
4
-
-
79958026399
-
An in situ study of the hydriding kinetics of Pd thin films
-
Delmelle R., Proost J. An in situ study of the hydriding kinetics of Pd thin films. Phys. Chem. Chem. Phys. 2011, 13:11412-11421.
-
(2011)
Phys. Chem. Chem. Phys.
, vol.13
, pp. 11412-11421
-
-
Delmelle, R.1
Proost, J.2
-
5
-
-
67651211668
-
The effect of hydrogenation/dehydrogenation cycles on palladium physical properties
-
Tripodi P., Armanet N., Asarisi V., Avveduto A. The effect of hydrogenation/dehydrogenation cycles on palladium physical properties. Phys. Lett. A 2009, 373:3101-3108.
-
(2009)
Phys. Lett. A
, vol.373
, pp. 3101-3108
-
-
Tripodi, P.1
Armanet, N.2
Asarisi, V.3
Avveduto, A.4
-
6
-
-
0000670352
-
Order-disorder transitions and subsurface occupation for hydrogen on Pd(111)
-
Felter T.E., Foiles S.M., Daw M.S., Stulen R.H. Order-disorder transitions and subsurface occupation for hydrogen on Pd(111). Surf. Sci. Lett. 1986, 171:L379.
-
(1986)
Surf. Sci. Lett.
, vol.171
-
-
Felter, T.E.1
Foiles, S.M.2
Daw, M.S.3
Stulen, R.H.4
-
7
-
-
0035839710
-
Membrane reactors for hydrogenation and dehydrogenation processes based on supported palladium
-
Dittmeyer R., Höllein V., Daub K. Membrane reactors for hydrogenation and dehydrogenation processes based on supported palladium. J. Mol. Catal. A: Chem. 2001, 173:135-184.
-
(2001)
J. Mol. Catal. A: Chem.
, vol.173
, pp. 135-184
-
-
Dittmeyer, R.1
Höllein, V.2
Daub, K.3
-
8
-
-
0034712618
-
Electronic factors governing ethylene hydrogenation and dehydrogenation activity of pseudomorphic PdML/Re(0001), PdML/Ru(0001), Pd(111), and PdML/Au(111) surfaces
-
Pallassana V., Neurock M. Electronic factors governing ethylene hydrogenation and dehydrogenation activity of pseudomorphic PdML/Re(0001), PdML/Ru(0001), Pd(111), and PdML/Au(111) surfaces. J. Catal. 2000, 191:301-317.
-
(2000)
J. Catal.
, vol.191
, pp. 301-317
-
-
Pallassana, V.1
Neurock, M.2
-
9
-
-
77649231421
-
Hydrogen adsorption on palladium and palladium hydride at 1 bar
-
Johansson M., Skúlason E., Nielsen G., Murphy S. Hydrogen adsorption on palladium and palladium hydride at 1 bar. Surf. Sci. 2010, 604:718-729.
-
(2010)
Surf. Sci.
, vol.604
, pp. 718-729
-
-
Johansson, M.1
Skúlason, E.2
Nielsen, G.3
Murphy, S.4
-
11
-
-
42649120662
-
Interaction of hydrogen with palladium surface. FIM and FEM studies
-
Tomaszewska A., Ciszewski A., Stepien Z.M. Interaction of hydrogen with palladium surface. FIM and FEM studies. Appl. Surf. Sci. 2008, 254:4386-4390.
-
(2008)
Appl. Surf. Sci.
, vol.254
, pp. 4386-4390
-
-
Tomaszewska, A.1
Ciszewski, A.2
Stepien, Z.M.3
-
12
-
-
0041488854
-
Hydrogen adsorption and diffusion on Pd(111)
-
Mitsui T., Rose M.K., Fomin E., Ogletree D.F., Salmeron M. Hydrogen adsorption and diffusion on Pd(111). Surf. Sci. 2003, 540:5-11.
-
(2003)
Surf. Sci.
, vol.540
, pp. 5-11
-
-
Mitsui, T.1
Rose, M.K.2
Fomin, E.3
Ogletree, D.F.4
Salmeron, M.5
-
19
-
-
33645898818
-
Accurate and simple analytic representation of the electron-gas correlation energy
-
Perdew J.P., Wang Y. Accurate and simple analytic representation of the electron-gas correlation energy. Phys. Rev. B 1992, 45:13244.
-
(1992)
Phys. Rev. B
, vol.45
, pp. 13244
-
-
Perdew, J.P.1
Wang, Y.2
-
21
-
-
36549092018
-
Energy-adjusted ab initio pseudopotentials for the first row transition elements
-
Dolg M., Wedig U., Stoll H., Preuss H. Energy-adjusted ab initio pseudopotentials for the first row transition elements. J. Chem. Phys. 1987, 86:866.
-
(1987)
J. Chem. Phys.
, vol.86
, pp. 866
-
-
Dolg, M.1
Wedig, U.2
Stoll, H.3
Preuss, H.4
-
22
-
-
84944675147
-
Ab initio energy-adjusted pseudopotentials for elements of groups 13-17
-
Bergner A., Dolg M., Kuechle W., Stoll H., Preuss H. Ab initio energy-adjusted pseudopotentials for elements of groups 13-17. Mol. Phys. 1993, 80:1431.
-
(1993)
Mol. Phys.
, vol.80
, pp. 1431
-
-
Bergner, A.1
Dolg, M.2
Kuechle, W.3
Stoll, H.4
Preuss, H.5
-
23
-
-
34447260582
-
An all-electron numerical method for solving the local density functional for polyatomic molecules
-
Delley B. An all-electron numerical method for solving the local density functional for polyatomic molecules. J. Chem. Phys. 1990, 92:508.
-
(1990)
J. Chem. Phys.
, vol.92
, pp. 508
-
-
Delley, B.1
-
24
-
-
0001553329
-
Bonded-atom fragments for describing molecular charge densities
-
Hirshfeld F.L. Bonded-atom fragments for describing molecular charge densities. Theor. Chim. Acta B 1977, 44:129.
-
(1977)
Theor. Chim. Acta B
, vol.44
, pp. 129
-
-
Hirshfeld, F.L.1
-
25
-
-
0001149392
-
The synchronous-transit method for determining reaction pathways and locating molecular transition states
-
Halgren T.A., Lipscomb W.N. The synchronous-transit method for determining reaction pathways and locating molecular transition states. Chem. Phys. Lett. 1977, 49:225.
-
(1977)
Chem. Phys. Lett.
, vol.49
, pp. 225
-
-
Halgren, T.A.1
Lipscomb, W.N.2
-
28
-
-
0001565322
-
Hyperfine interaction and chemical bonding in the PdH molecule
-
Knight L.B., Weltner W. Hyperfine interaction and chemical bonding in the PdH molecule. J. Mol. Spectrosc. 1971, 40:317.
-
(1971)
J. Mol. Spectrosc.
, vol.40
, pp. 317
-
-
Knight, L.B.1
Weltner, W.2
-
29
-
-
0000732852
-
Homolytic and heterolytic bond dissociation energies of the second row group 8, 9, and 10 diatomic transition-metal hydrides: correlation with electronic structure
-
Tolbert M.A., Beauchamp J.L. Homolytic and heterolytic bond dissociation energies of the second row group 8, 9, and 10 diatomic transition-metal hydrides: correlation with electronic structure. J. Phys. Chem. 1986, 90:5015.
-
(1986)
J. Phys. Chem.
, vol.90
, pp. 5015
-
-
Tolbert, M.A.1
Beauchamp, J.L.2
-
30
-
-
0142008382
-
A generalized synchronous transit method for transition state location
-
Govind N., Petersen M., Fitzgerald G., King-Smith D. A generalized synchronous transit method for transition state location. J. Comput. Mater. Sci. 2003, 28:250.
-
(2003)
J. Comput. Mater. Sci.
, vol.28
, pp. 250
-
-
Govind, N.1
Petersen, M.2
Fitzgerald, G.3
King-Smith, D.4
|