Busnengo HF - Search Results

1

Reactive force fields for surface chemical reactions: A case study with hydrogen dissociation on Pd surfaces.

Xiao Y, Dong W, Busnengo HF. Xiao Y, et al. Among authors: busnengo hf. J Chem Phys. 2010 Jan 7;132(1):014704. doi: 10.1063/1.3265854. J Chem Phys. 2010. PMID: 20078177

2

Surface temperature dependence of rotational excitation of H(2) scattered from Pd(111).

Busnengo HF, Dong W, Sautet P, Salin A. Busnengo HF, et al. Phys Rev Lett. 2001 Sep 17;87(12):127601. doi: 10.1103/PhysRevLett.87.127601. Epub 2001 Aug 30. Phys Rev Lett. 2001. PMID: 11580558

3

Towards bond selective chemistry from first principles: methane on metal surfaces.

Shen XJ, Lozano A, Dong W, Busnengo HF, Yan XH. Shen XJ, et al. Among authors: busnengo hf. Phys Rev Lett. 2014 Jan 31;112(4):046101. doi: 10.1103/PhysRevLett.112.046101. Epub 2014 Jan 28. Phys Rev Lett. 2014. PMID: 24580470

4

Nonthermalized Precursor-Mediated Dissociative Chemisorption at High Catalysis Temperatures.

Moiraghi R, Lozano A, Peterson E, Utz A, Dong W, Busnengo HF. Moiraghi R, et al. Among authors: busnengo hf. J Phys Chem Lett. 2020 Mar 19;11(6):2211-2218. doi: 10.1021/acs.jpclett.0c00260. Epub 2020 Mar 5. J Phys Chem Lett. 2020. PMID: 32073863

5

Trapping, molecular adsorption, and precursors for nonactivated chemisorption.

Busnengo HF, Dong W, Salin A. Busnengo HF, et al. Phys Rev Lett. 2004 Dec 3;93(23):236103. doi: 10.1103/PhysRevLett.93.236103. Epub 2004 Dec 1. Phys Rev Lett. 2004. PMID: 15601177

6

Chain-length and temperature dependence of self-assembled monolayers of alkylthiolates on Au(111) and Ag(111) surfaces.

Wang Y, Solano Canchaya JG, Dong W, Alcamí M, Busnengo HF, Martín F. Wang Y, et al. Among authors: busnengo hf. J Phys Chem A. 2014 Jun 12;118(23):4138-46. doi: 10.1021/jp412285v. Epub 2014 Jun 2. J Phys Chem A. 2014. PMID: 24856824

7

Relaxation of hot atoms following H2 dissociation on a Pd111 surface.

Pineau N, Busnengo HF, Rayez JC, Salin A. Pineau N, et al. Among authors: busnengo hf. J Chem Phys. 2005 Jun 1;122(21):214705. doi: 10.1063/1.1924550. J Chem Phys. 2005. PMID: 15974760

8

Dynamics of H2 Eley-Rideal abstraction from W(110): sensitivity to the representation of the molecule-surface potential.

Pétuya R, Larrégaray P, Crespos C, Busnengo HF, Martínez AE. Pétuya R, et al. Among authors: busnengo hf. J Chem Phys. 2014 Jul 14;141(2):024701. doi: 10.1063/1.4885139. J Chem Phys. 2014. PMID: 25028032

9

Communication: Hot-atom abstraction dynamics of hydrogen from tungsten surfaces: The role of surface structure.

Galparsoro O, Busnengo HF, Juaristi JI, Crespos C, Alducin M, Larregaray P. Galparsoro O, et al. Among authors: busnengo hf. J Chem Phys. 2017 Sep 28;147(12):121103. doi: 10.1063/1.4997127. J Chem Phys. 2017. PMID: 28964038

10

The role of exchange-correlation functionals in the potential energy surface and dynamics of N(2) dissociation on W surfaces.

Bocan GA, Díez Muiño R, Alducin M, Busnengo HF, Salin A. Bocan GA, et al. Among authors: busnengo hf. J Chem Phys. 2008 Apr 21;128(15):154704. doi: 10.1063/1.2897757. J Chem Phys. 2008. PMID: 18433255 Free article.

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