Cristina Díaz
Publications
2025
96. Impact Assessment of Internacional Cooperation in Higher Education in Africa: The Key Role of UCMJosé Manuel Sagovia Guisado, Yolanda Jiménez Valdericeda, Cristina Díaz Blanco
ACREDITAS, 16 10 (2025)
Abstract
Full text (Open access)
95. Tunable Doping and Optoelectronic Modulation in Graphene-Covered 4H-SiC Surfaces
Masoud Mansouri, Fernando Martín, Cristina Díaz
Journal Physical Chemistry C, 129 4155 (2025)
IF: 3.2 Abstract
Full text (author version)
2024
94. Jumping Dynamics of Cyanomethyl Radicals on Corrugated Graphene/Ru(0001) SubstratesMichele Pisarra, Juan Jesús Navarro, Cristina Díaz , Fabián Calleja, Amadeo L. Vázquez de Parga, Fernando Martín
Journal of Physical Chemistry C, 128 21408 (2024)
IF: 3.2 Abstract
Full text (Open access)
93. Single-Molecule Conductance of Neutral Closed-Shell and Open-Shell Diradical Indenofluorenes
Raquel Casares, Sandra Rodríguez-González, Álvaro Martínez-Pinel, Irene R. Márquez, M. Teresa González, Cristina Díaz , Fernando Martín, Juan M. Cuerva, Edmund Leary, Alba Millán
Journal of the American Chemical Society, 146 29977 (2024)
IF: 15.6 Abstract
Full text (Open access)
92. Optoelectronic properties of electronacceptor molecules adsorbed on graphene/silicon carbide interfaces
Masoud Mansouri, C. Díaz , Fernando Martín
Communications Materials 5:117 (2024)
IF: 9.6 Abstract
Full text (Open access)
91. Semiquantum versus quantum methods for grazing-incidence fast-atom diffraction: Influence of the wave-packet size
A. S. Muzas, L. Frisco, G. A. Bocan, C. Díaz M. S. Gravielle
Physical Review A 109 042823 (2024)
IF: 2.9 Abstract
Full text (Author version)
90. Tailoring single-molecule conductance with structured graphene electrodes
Joel G. Fallaque, Sandra Rodríguez-González, Cristina Díaz , Fernando Martín
Applied Surface Science 646 158943 (2024)
IF: 6.9 Abstract
Full text (Open access)
2022
89. Graphene grown on transition metal substrates: Versatile templates for organic molecules with new properties and structuresCristina Díaz, Fabián Calleja, Amadeo L. Vázquez de Parga, Fernando Martín
Surface Science Reports (2022) 77 100575 (2022)
IF: 9.8 Abstract
Full text (Open access)
88. Self-energy corrected DFT-NEGF for conductance in molecular junctions: an accurate and efficient implementation for TRANSIESTA package applied to Au electrodes
Joel G Fallaque, Sandra Rodríguez-González, Fernando Martín, C. Díaz
Journal of Physics: Condensed Matter, 34 435901 (2022)
IF: 2.7 Abstract
Full text (author version)
87. Engineering the HOMO-LUMO gap of indeno[1,2-b]fluorene
Raquel Casares, &Aaute;lvaro Martínez-Pinel, Sandra Rodríguez-González, Irene R. Márquez, Luis Lezama, M. Teresa González, Edmund Leary, Víctor Blanco, Joel G. Fallaque, C. Díaz Fernando Martín, Juan M. Cuerva, Alba Millán
Journal of Materials Chemistry C, 10 11775 (2022)
IF: 6.4 Abstract
Full text (Open access)
86. Stereodynamics effects in grazing-incidence fast-molecule diffraction
Marcos del Cueto, Alberto S. Muzas, Fernando Martín, C. Díaz
Physical Chemistry Chemical Physics 24 19541 (2022)
IF: 3.3 Abstract
Full text (Author version)
85. Grazing incidence fast atom and molecule diffraction: theoretical challenges
Cristina Díaz , María Silvia Gravielle
Physical Chemistry Chemical Physics 24 15628 (2022)
IF: 3.3 Abstract
Full text (Author version)
84. A simple model to engineer single-molecule conductance of acenes by chemical disubstitution
Joel G. Fallaque, Sandra Rodr$iacute;guez-González, Cristina Díaz , Fernando Martín
Nanoscale 14 464 (2022)
IF: 6.7 Abstract
Full text (Author version)
2021
83. Efficient photogeneration of nonacene on nanostructured grapheneCosme G. Ayani, Michele Pisarra, José I. Urgel, Juan Jesús Navarro, Cristina Díaz , Hironobu Hayashi, Hiroko Yamada, Fabian Calleja, Rodolfo Miranda, Roman Fasel, Fernando Mart%iacute;n, Amadeo L. Va´zquez de Parga
Nanoscale Horizons 6 744 (2021)
IF: 11.68 Abstract
Full text (Author version)
82. Theoretical study of structural and electronic properties of 2H-phase transition metal dichalcogenides
M. Pisarra, C. Díaz , F. Martín
Physical Review B 103 195419 (2021)
IF:3.575 Abstract
Full text (Author version)
81. Evaluation of the role of graphene-based Cu(I) catalysts in borylation reactions
M. Franco, R. Sainz, A. M. Lamsabhi, C. Díaz , M. Tortosa, M. B. Cid
Catalysis Science & Technology 11 3501 (2021)
IF:5.721 Abstract
Full text (Author version)
80. Single-Molecule Conductance of 1,4-Azaborine Derivatives as Model of BN-doped PAHs
L. Palomino-Ruiz, S. Rodríguez-González, J. G. Fallaque, I. R. Márquez, N. Agrait, C. Díaz , E. Leary, J. M. Cuerva, A. G. Campaña, F. Martín, A. Millán, M. T. González
Angewandte Chemie International Edition 60 6609 (2021)
IF:12.96 Abstract
Full text (Author version)
79. Normal and off-normal incidence dissociative dynamics of O2(v,J) on ultrathin Cu films grown on Ru(0001)
J. G. Fallaque, M. Ramos, H. F. Busnengo, F. Martín, C. Díaz
Physical Chemistry Chemical Physics 23 7768 (2021)
IF:3.43 Abstract
Full text (Author version)
2020
78. Defect formation in a graphene overlayer on ruthenium under high pressureM. Pisarra, C. Díaz , F. Martín
Physical Review B 102 075406 (2020)
IF:3.575 Abstract
77. Accurate simulations of atomic diffractive scattering from KCl(001) under fast grazing incidence conditons
M. del Cueto, A. S. Muzas, F. Martín, C. Díaz
Nuclear Instruments and Methods in Physics Research B 476 1 (2020)
IF:1.27 Abstract
Full text (Author version)
2019
76. Prominent out-of-plane diffracton in helium scattering from a methyl-terminated Si(111) surfaceM. del Cueto, A. S. Muzas, T. J. Frankcombe, F. Martín, C. Díaz
Physical Chemistry Chemical Physics 21 15879 (2019)
IF:3.430 Abstract
75. Quantum Stereodynamics of Hu2 Scattering from Co(0001): Influence of Reaction Channels
M. del Cueto, X. Zhou, A. S. Muzas, C. Díaz , F. Martín, B. Jiang, H. Guo
Journal of Physical Chemistry C 123 16223 (2019)
IF:4.189 Abstract
74. Performance of van der Waals DFT approaches for helium diffraction on metal surfaces
M. del Cueto, M. J. Reinhard, A. Al Taleb, D. Farías, F. Martín, C. Díaz
Journal of Physics: Condensed Matter 31 135901 (2019)
IF:2.705 Abstract
73. Local tuning of graphene electronic properties upon ultrahigh pressures
P. Ares, M. Pisarra, P. Segovia, C. Díaz , F. Martín, E. G. Michel, F. Zamora, C. Gómez-Navarro, and J. Gómez-Herrero
Advanced Funtional Materials 1806715 (2019)
IF:13.325 Abstract
72. Non-adiabatic Scattering of NO off Au3 Clusters: A simple and robust diabatic state manifold generation method for multiconfigurational
C. Robertson, J. González-Vázquez, S. Díaz-Tendero, I. Corral, and C. Díaz
Journal of Computational Chemistry 40 794 (2019)
IF:3.221 Abstract
2018
71. Graphene catalyzes the reversible formation of a C-C bond between two moleculesJ.J. Navarro, M. Pisarra, B. Nieto-Ortega, J. Villalva, C. Díaz , F. Calleja, R. Miranda, F. Martín, E. M. Pérez, and A. L. Vázquez de Parga
Science Advances 4 9366 (2018)
IF:11.511 Abstract
70. Thickness-Dependent Reactivity of O2 on Cu Layers Grown on Ru(0001) Surfaces
M. Ramos, C. Díaz , A. E. Martínez, F. Martín and H. F. Busnenego
Journal of Physical Chemistry C 122 15529 (2018)
IF:4.484 Abstract
69. Molecular modelling of the H2-adsorptive properties of tetrazolate-based metal-organic frameworks: from the cluster approach to periodic simulations
O. Brea, A. Luna, C. Díaz and I. Corral
ChemPhysChem 19 1349 (2018)
IF:2.947 Abstract
68. Electronic properties of sulfur covered Ru(0001) Surfaces
M. Pisarra, C. Díaz , R. Bernardo-Gavito, J. J. Navarro, A. Black, F. Calleja, D. Granados, R. Miranda, A. L. Vázquez de Varga and F. Martín
The Journal of Physical Chemistry A 122 2231-2240 (2018)
IF:2.836 Abstract
67. Theoretical aspects of hydrogen dynamics at metal surfaces
C. Díaz
Encyclopedia of Interfacial Chemistry -Surface Science and Electrochemistry. Elsevier vol. 2 281-291 (2018). ISBN 978-0-12-809739-7
66. Including London dispersion forces in DFT (DFT-D)
C. Díaz , Y. Wang and F. Martín
Encyclopedia of Interfacial Chemistry -Surface Science and Electrochemistry. Elsevier vol. 4 75-83 (2018). ISBN 978-0-12-809739-7
65. Coverage evolution of the unoccupied Density of States in sulfur superstructures on Ru(0001)
M. Pisarra, R. Bernardo-Gavito, J. J. Navarro, A. Black, C. Díaz , F. Calleja, D. Granados, R. Miranda, F. Martín and A. L. Vázquez de Varga
Applied Surface Science 433 300 (2018)
IF:4.439 Abstract
2017
64. H2/LiF(001) diffractive scattering under fast grazing incidence using a DFT-based potential energy surfaceA. S. Muzas, M. del Cueto, F. Gatti, M. F. Somers, G. J. Kroes, F. Martín and C. Díaz
Physical Review B 96 205432 (2017)
IF:3.813 Abstract
63. Exploring surface landscapes with molecules: rotationally induced diffraction of H2 on LiF(001) under fast grazing incidence conditions
M. del Cueto, A. S. Muzas, M. F. Somers, G. J. Kroes, C. Díaz and F. Martín
Physical Chemistry Chemical Physics 19 16317 (2017)
IF:3.906 Abstract
62. A DFT study of Cu nanoparticles adsorbed on defective graphene
D. E. García-Rodríguez, L. H. Mendoza-Huizar and C. Díaz
Applied Surface Science 412 146 (2017)
IF:4.439 Abstract
61. Dissociative and non dissociatice adsorption of O2 on Cu(111) and CuML surfaces: adiabaticy takes over
M. Ramos, C. Díaz , A. E. Martínez, H. F. Busnengo and F. Martín
Physical Chemistry Chemical Physics 19 10217 (2017)
IF:3.906 Abstract
2016
60. Enigmatic HCl+Au(111) reaction: A puzzle for theory and experimentG. Fuchsel, M. del Cueto, C. Díaz and G. J. Kroes
Journal of Chemical Physics C, 120 25760 (2016)
IF:4.536 Abstract
59. Experimental and theoretical study of rotationallu inelastic diffraction of H2(D2) from methyl-terminates Si(111)
K. J. Nihill, Z. M. Hund, A. S. Muzas, C. Díaz , M. del Cueto, T. Frankcombe, N. T. Plymale, N. S. Lewis, F. Martín, and S. J. Sibener
Journal of Physical Chemistry, 145 084705 (2016)
IF:2.965 Abstract
58. Diffraction of H from LiF(001): From slow normal incidence to fast grazing incidence
A. S. Muzas, F. Gatti, F. Martín, C. Díaz
Nuclear Instruments and Methods in Physics Research B, 382 49 (2016)
IF:1.109 Abstract
57. Quantum and classical dynamics of reactive scattering of H2 from metal surfaces
G. J. Kroes, C. Díaz
Chemical Society Review, 45 3658 (2016)
IF:38.618 Abstract
56. The role of van del Waals forces in the diffraction of noble gases from metal surfaces
M. del Cueto, A. S. Muzas, G. Fuchsel, F. Gatti, F. Martín, C. Díaz
Physical Review B, 93 060301(R) (2016)
IF:3.836 Abstract
55. Understanding the seft-assembly of TCNQ on Cu(111): a combined sutdy based on scanning tunneling microscopy esperiments and density functional theory simulations
D. Stradi, D. Borca, S. Barja, M. Garnica, C. Díaz , J. M. Rodríguez-García, M. Alcamí, A. L. Váquez de Parga, R. Miranda, F. Martín
RSC Advances, 6 15071 (2016)
IF:3.108 Abstract
2015
54. The role of the initial ro-vibrational state in molecule/surface scattering under fast grazing incidenceA. S. Muzas, F. Martín, C. Díaz
Journal of Physics: Conference series 635 012029 (2015)
Abstract
53. Assesing the reliability of van der Waals DFT functionals to study the physisorption of molecular hydrogen on aromatic systems
C. Díaz
Theoretical Chemistry Accounts, 134 105 (2015)
IF:1.806 Abstract
52. Scattering of H(D) from LiF(100) under fast grazing incidence conditions: To what extent is classical dynamics a useful tool?.
A. S. Muzas, F. Martín, C. Díaz
Nuclear Instruments and Methods in Physics Research B, 354 9 (2015)
IF:1.389 Abstract
2014
51. Controlling the spatial arrangement of organic magnetic anions adsorbed on epitaxial graphene on Ru(0001).D. Stradi, M. Garnica, C. Díaz , F. Calleja, S. Barja, N. Martín, M, Alcamí, A. L. Vazquez de Parga, R. Miranda and F. Martín
Nanoscale, 6 15271 (2014)
IF:7.394 Abstract
50. Dissociation and recombination of D2 on Cu(111): Ab initio Molecular Dynamics Calculations and Improved Analysis of Desorption Experiments.
F. Nattino, A. Genova, M. Guijt, A. S. Muzas, C. Díaz , D. J. Auerbach and G. J. Kroes
Journal of Chemical Physics, 141 124705 (2014)
IF:2.952 Abstract
49. Probing the Site-Dependent Kondo Response of Nanostructured Graphene with Organic Molecules.
M. Garnica, D. Stradi, F. Callejo, S. Barja, C. Díaz , M. Alcamí, A. Arnau, A. L. Vázquez de Parga, F. Martín and R. Miranda
Nano Letters, 14 4560-4567 (2014)
IF:13.592 Abstract
48. Theoretical simulations of reactive and non-reactive scattering of ligh diatomic molecules from metal surfaces: Past, present and future.
C. Díaz
Advances in Chemistry. ID 175352 (2014)
Abstract
47. Elementary Molecule-Surface Scattering Processes Relevant to Heterogenerous Catalysis: Insights from Quantum Dynamics Calculations.
C. Díaz, A. Gross, B. Jackson and G. J. Kroes
Molecular Quantum Dynamics: From Theory to Applications. Springer, Physical Chemistry in Action Sciences (2013) ISBN 978-3-642-45289-5
2013
46. Lattice-marched versus lattice-mismatched models to describe epitaxial monolayer graphene on Ru(0001)D. Stradi, S. Barja, C. Díaz, M. Garnica, B. Borca, J. J. Hinarejos, D. Sánchez-Portal, M. Alcamí, A. Arnau, A. López-Vázquez de Parga, R. Miranda and F. Martín
Physical Review B, 88245401 (2013)
IF:2.223 Abstract
45. Environment-driven reactivity of H2 on PdRu surface alloys.
M. Ramos, M. Minniti, C. Díaz, D. Farías, R. Miranda, F. Martín, A. E. Martínez and H. F. Busnengo
Physical Chemistry Chemical Physics, 15 14936 (2013)
IF:4.198 Abstract
44. Thermal Lattice Expansion Effect on Reactive Scattering of H2 from Cu(111) at Ts=925 K.
A. Mondal, M. Wijzenbroek, M. Bonfanti, C. Díaz and G. J. Kroes
Journal of Physical Chemistry A, 117 8770 (2013)
IF:2.775 Abstract
43. Ordered arrays of metal-organic magnets at surfaces
S. Barja, D. Stradi, B. Borca, M. Garnica, C. Díaz, M. Rodríquez-Garcíz, M. Alcamí, A. López-Vázquez de Parga, F. Martín and R. Miranda
Journal of Physics: Condensed Matter, a24354002 (2013)
IF:2.223 Abstract
42. 7D Quantum Dynamics of H2 scattering from Cu(111): the accuracy of the phonon sudden approximation
M. Bonfanti, M. F. Somers, C. Díaz, H. F. Busnengo and G.-J. Kroes
Zeitschrift fur physikalische Chemie, 2271397 (2013)
IF:1.178 Abstract
41. Long-range magnetic order in a purely organic 2D layer adsorbed on epitaxial graphene
M. Garnica, D. Stradi, A. Barja, F. Calleja, C. Díaz, M. Alcamí, N. Martín, A. López-Vázquez de Parga, F. Martín and R. Miranda
Nature Physics, 9 368 (2013)
IF:20.603 Abstract
40. Elastic Response of Graphene Nanodomes
A. Koch, D. Stradi, E. Gnecco, A. Barja, S. Kawai, C. Díaz, M. Alcamí, F. Martín, A. López-Vázquez de Parga, R. Miranda, T. Glatzel and E. Meyer
ACS Nano, 7 2927 (2013)
IF:12.033 Abstract
39. Using Molecular Reflectivity to Explore Reaction Dynamics at Metal Surfaces
C. Díaz and F. Martín
Dynamics of Gas-Surface Interaction: Atomic-Level Undertanding of Scaattering Processes at Surfaces. Springer Series in Surface Sciences (2013) ISBN 978-3-642-32954-8/ISBN 978-3-642-32955-5
2012
38. Vibrational deexcitation and rotational excitation of H2 and D2 scattered from Cu(111): Adiabatic versus non-adiabatic dynamicsA. S. Muzas, J. I. Juaristi, M. Alducin, E. Díez-Muiño, G. J. Kroes and C. Díaz
Journal Chemical Physics, 137 064707 (2012)
IF:3.164 Abstract
37. Helium, neon and argon diffraction from Ru(0001)
M. Minniti, C. Díaz, J. L. Feirnández Cuñado, A. Politano, D. Maccariello, F. Martín, D. Farías and R. Miranda
Journal of Physics: Condensed Matter, 24 354002 (2012)
IF:2.355 Abstract
36. H2 diffraction from a strained pseudomorphic monolayer of Cu deposited on Ru(0001)
C. Díaz, F. Martín, G. J. Kroes, M. Minniti, D. Farías and R. Miranda
Journal Physical Chemistry C, 116 13671 (2012)
IF:4.814 Abstract
35. Effect of surface motion on the rotational quadrupole alignment parameter on D2 reacting on Cu(111)
F. Nattino, C. Díaz, B. Jackson and G. J. Kroes
Physical Review Letters, 108 236104 (2012)
IF:7.943 Abstract
34. Electron localization in epitaxial graphene on Ru(0001) determined by moiré corrugation
S. Stradi, S. Barja, C. Díaz, M. Garnica, B. Borca, J. J. Hinarejos, D. Sánchez-Portal, M. Alcamí, A. Arnau, A. L. Vázquez de Parga, R. Miranda and F. Martín
Physical Review B, 85 121404(R) (2012)
IF:3.767 Abstract
33. Dynamics of H2 dissociation on the 1/2 ML c(2x2)-Ti/Al(100) surface
J.-C. Chen, M. Ramos, C. Arasa, J. C. Juanes-Marcos, M. F. Somers, A. E. Martínez C. Díaz, R. A. Olsen and G. J. Kroes
Physical Chemistry Chemical Physics, 14 3234 (2012)
IF:3.829 Abstract
2011
32. Role of dispersion forces in the structure of graphene monolayers over Ru surfacesD. Stradi, S. Barja, C. Díaz, M. Garnica, B. Borca, J. J. Hinarejos, D. Sánchez-Portal, M. Alcamí, A. Arnau, A. L. Vázquez de Parga, R. Miranda and F. Martín
Physical Review Letters, 106 186102 (2011)
IF:7.370 Abstract
31. Six-dimensional quasiclassical and quantum dynamics of H2 dissociation on the c(2x2)-Ti/Al(100) surface
J. C. Chen, J. C. Juanes-Marcos, S. Woittequand, M. F. Somers, C. Díaz, R. A. Olsen and G. J. Kroes
Journal of Chemical Physics, 134 114708 (2011)
IF:3.333 Abstract
30. Hydrogen dissociation on Cu(111): the influence of lattice motion. I
M. Bonfanti, C. Díaz, M. F. Somers and G. J. Kroes
Physical Chemistry Chemical Physics, 13 4552 (2011)
IF: 3.573 Abstract
29. A density functional theory study of the manganese-phthalocyanine
D. Stradi, C. Díaz, F. Martín and M. Alcamí
Theoretical Chemistry Accounts, 128 497 (2011)
IF:2.162 Abstract
2010
28. Apparent failure of the Born-Oppenheimer static surface model for vibrational excitation of molecular hydrogen on copperG. J. Kroes, C. Díaz, E. Pijper, R. A Olsen and D. J. Auerbach
Proceedings of the National Academy of Science, 107 20881 (2010)
IF:9.771 (T1,Q1,D1) Abstract
27. Experimental and Theoretical Study of Rotationally Inelastic Diffraction of D2 from NiAl(110)
G. Laurent, D. Barredo, D. Farías, R. Miranda, C. Díaz, P. Rivière, M. F. Somers and F. Martín
Physical Chemistry Chemical Physics 12 14501 (2010)
IF:3.545 Abstract
26. Grazing incidence scattering of vibrationally excited H2 molecules from metal surfaces.
D. Stradi, C. Díaz and F. Martín
Surface Science 604 2031 (2010)
IF:2.011 Abstract
25. Reactive scattering of H2 from metal surfaces under fast grazing incidence conditions.
C. Díaz and F. Martín
Physical Review A 82 012901 (2010)
IF:2.861 Abstract
24. Dynamics on six-dimensional potential energy surface for H2/Cu(111): Corrugation reducing procedure versus modified Shepard interpolation method and PW91 versus RPBE.
C. Díaz, R. A. Olsen, H. F. Busnengo and G. J. Kroes
Journal of Physical Chemistry C 114 11192 (2010)
IF:4.524 (T1,Q1) Abstract
23. Six-dimensional dynamics study of reactive and non reactive scattering of H2 from Cu(111) using a chemically accurate potential energy surface.
C. Díaz, R. A. Olsen, D. J. Auerbach and G. J. Kroes
Physical Chemistry Chemical Physics 12 6499 (2010)
IF:3.454 Abstract
22. Nonmonotonic dissociative adsorption of vibrationally excited H2 on metal surfaces
G. Laurent, C. Díaz, H. F. Busnengo and F. Martín
Physical Review B 81 161404 (2010)
IF:3.774 Abstract
21. Dynamics of dissociative adsorption of hydrogen on a CO-precovered Ru(0001) surface: a comparison of theoretical and experimental results.
I. M. N. Groot, J. C. Juanes-Marcos, C. Díaz, M. F. Somers, R. A. Olsen and G. J. Kroes
Physical Chemistry Chemical Physics 12 1331 (2010)
IF:3.454 Abstract
2009
20. A note on the vibrational efficacy in molecule-surface reactionsC. Díaz, and R. A. Olsen
Journal of Chemical Physics 130 094706 (2009)
IF:3.093 Abstract
19. Chemically accurate simulation of a prototypical surfaces reaction: H2 Dissociation on Cu(111)
C. Díaz, E. Pijper, R. A. Olsen, H. F. Busnengo, D. J. Auerbach and G. J. Kroes
Science 326 832 (2009)
IF:29.747 Abstract
18. Molecular effects in H2 scattering from metal surfaces at grazing incidence
C. Díaz, P. Rivière and F. Martín
Physical Review Letters 103 013201 (2009)
IF:7.328 Abstract
17. Molecular effects in grazing incidence collisions of H2 with metal surfaces
C. Díaz, P. Rivière and F. Martín
Journal of Physics: Conference Series 194 012058 (2009)
2008
16. Application of Desktop Grid in Surface ScienceC. Díaz and M. F. Somers
Distributed & Grid Computing-Science Made Transparent for Everyone: Principles, Applications and Supporting Communities. Ed. M.H.W. Weber, Rechenkraft.net e.V. Marburg, Germany (2008)
2007
15. Associative desorption of N2 from Ru(0001): A computational studyC. Díaz, A. Perrier and G. J. Kroes
Chemical Physics Letters 434 231 (2007)
IF:2.207 Abstract
2006
14. Dynamics of H2 chemisorption on metal surfacesH. F. Busnengo, C. Díaz, P. Riviere, M. A. Di Cesare, F. Martín, W. Dong and A. Salin
Photonic, Electronic and Atomic Collisions 625 (2006)
13. Rective and non reactive scattering of N2 from Ru(0001): A six-dimensional adiabatic study
C. Díaz, J. K. Vincent, G. P. Krishnamohan, R. A. Olsen, G. J. Kroes, K. Honkala and J. K. Norskov
Journal of Chemical Physics 125 114706 (2006)
IF:3.166 Abstract
12. Multidimensional effects on dissociation of N2 on Ru(0001)
C. Díaz, J. K. Vincent, G. P. Krishnamohan, R. A. Olsen, G. J. Kroes, K. Honkala and J. K. Norskov
Physical Review Letters 96 096102 (2006)
IF:7.072 Abstract
11. Experimental Evidence of Dynamic Trapping in the Scattering of H2 from Pd(110).
D. Barredo, G. Laurent, C. Díaz, P. Nieto, H. F. Busnengo, A. Salin, D. Farias andF. Martín
Journal of Chemical Physics 125 051101 (2006)
IF:3.166 Abstract
2005
10. Quantum and classicaldynamics of H2 scattering from Pd(111) at off-normalincidence.C. Díaz, M. F. Somers, G. J. Kroes, H. F. Busnengo, A. Salin and F. Martín
Physical Review B 72 035401 (2005)
IF:3.185 Absstract
9. A classical dynamicsmethod for H2 diffraction from metal surfaces.
C. Díaz, H. F. Busnengo, P. Riviere, D. Farías, P. Nieto, M. F. Somers, G. J. Kroes, A. Salin and F. Martín.
Journal of Chemical Physics 122 154706 (2005)
IF:3.138 Abstract
2004
8. In-plane and Out-of-Plane Diffraction of H2 from Metal SurfacesD. Farías, C. Díaz, P. Riviere, H.F. Busnengo, P. Nieto, M.F. Somers, G.J. Kroes, A. Salin and F. Martín
Physical Review Letters 93 246104 (2004)
IF:7.218 Abstract
7. Theoretical and experimental study of the scattering of H2 from a Pd(111) surface.
C. Díaz, H.F. Busnengo, P, Riviere F. Martín, A. Salin, P. Nieto, and F. Farías
Physica Scripta T110 394 (2004)
IF:0.661 Abstract
6. Pronounced out-of-plane diffraction of H2 from Pd(111).
D. Farías, C. Díaz, P. Nieto, A. Salin and F. Martín
Chemical Physical Letters 390 250 (2004)
IF:2.438 Abstract
5. Theoretical analysis of the relation between H2 dissociation and reflection on Pd surfaces.
C. Díaz, F. Martín, H. F. Busnengo and A. Salin
Journal of Chemical Physics 120 321 (2004)
IF:3.105 Abstract
2003
4. Angular distribution of H2 molecules scattered from del Pd(111) surface.C. Díaz, H.F. Busnengo, F. Martín, A. Salin
Journal of Chemical Physics 118 2886 (2003)
IF:2.950 Abstract
2002
3. Times-dependent close-coupling calculation of double ionization of helium by protons and antiprotonsC. Díaz, F. Martín and A. Salin
Journal of Physics B 35 2555 (2002)
IF:1.969 Abstract
2000
2. Double ionization of He by antiproton impact using a convergent frozen-correlation approximationC. Díaz, A. Salin and F. Martín
Journal of Physics B 33 L403-L409 (2000)
IF:2.332 Abstract
1. The role of dynamic correlation in double ionization of He by high-energy protons and antiprotons
C. Díaz, F. Martín and A. Salin
Journal of Physics B 33 4373-4388 (2000)
IF:2.332 Abstract