Universiteit Leiden

nl en

Mark Somers

Universitair docent

Naam
Dr. M.F. Somers
Telefoon
+31 71 527 4437
E-mail
m.somers@chem.leidenuniv.nl

Universitair docent

  • Wiskunde en Natuurwetenschappen
  • Leiden Institute of Chemistry
  • LIC/Theoretical Chemistry

Werkadres

Gorlaeus Laboratoria
Einsteinweg 55
2333 CC Leiden
Kamernummer DM014

Contact

  • Wiskunde en Natuurwetenschappen
  • Leiden Institute of Chemistry
  • LIC/Theoretical Chemistry

Werkadres

Gorlaeus Laboratoria
Einsteinweg 55
2333 CC Leiden

Contact

Ontwikkelaar ICT

  • Wiskunde en Natuurwetenschappen
  • Leiden Institute of Chemistry
  • LIC/Theoretical Chemistry

Werkadres

Gorlaeus Laboratoria
Einsteinweg 55
2333 CC Leiden
Kamernummer DM.014

Contact

  • Godsi O., Corem G., Alkoby Y., Cantin T., Krems R.V., Somers M.F. & Meyer J. (2017), A general method for controlling and resolving rotational orientation of molecules in molecule-surface collisions, Nature Communications 8: 15357.artikel in tijdschrift (refereed)
  • Nour-Ghassemi E., Wijzenbroek M., Somers M.F., Kroes & G.J. (2017), Chemically accurate simulation of dissociative chemisorption of D2 on Pt(111), CHEMICAL PHYSICS LETTERS 683: 329–335.artikel in tijdschrift (refereed)
  • Cueto M. del, Muzas A.S., Somers M.F., Kroes G.J., Díaz C. & Martín F. (2017), Exploring surface landscapes with molecules: rotationally induced diffraction of H2 on LiF(001) under fast grazing incidence conditions, PHYSICAL CHEMISTRY CHEMICAL PHYSICS 19(25): 16317-16322.artikel in tijdschrift (refereed)
  • Wijzenbroek M., Klein D.M., Smits B., Somers M.F. & Kroes G.J. (2015), Performance of a Non-Local Van der Waals Density Functional on the Dissociation of H2 on Metal Surfaces, Journal of Physical Chemistry A 119(50): 12146–12158.artikel in tijdschrift (refereed)
  • Bonfanti Matteo, Somers Mark F., Diaz Cristina, Fabio Busnengo Heriberto & Kroes Geert-Jan (2013), 7D Quantum Dynamics of H-2 Scattering from Cu(111): The Accuracy of the Phonon Sudden Approximation, ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-INTERNATIONAL JOURNAL OF RESEARCH IN PHYSICAL CHEMISTRY & CHEMICAL PHYSICS 227: 1397-1420.artikel in tijdschrift (refereed)
  • Boereboom J.M., Wijzenbroek M., Somers M.F. & Kroes G.J. (2013), Towards a specific reaction parameter density functional for reactive scattering of H2 from Pd(111), Journal of Chemical Physics 139: 244707.artikel in tijdschrift (refereed)
  • Sementa L., Wijzenbroek M., van Kolck B.J., Somers M.F., Al-Halabi A., Busnengo H.F., Olsen R.A., Kroes G.J., Rutkowski M., Thewes C., Kleimeier N.F. & Zacharias H. (2013), Reactive scattering of H-2 from Cu(100): Comparison of dynamics calculations based on the specific reaction parameter approach to density functional theory with experiment, Journal of Chemical Physics 138(4): 044708.artikel in tijdschrift (refereed)
  • Chen J.C., Ramos M., Arasa C., Juanes-Marcos J.C., Somers M.F., Martinez A.E., Diaz C., Olsen R.A. & Kroes G.J. (2012), Dynamics of H-2 dissociation on the 1/2 ML c(2 x 2)-Ti/Al(100) surface, PHYSICAL CHEMISTRY CHEMICAL PHYSICS 14(9): 3234-3247.artikel in tijdschrift (refereed)
  • Thomas P.S., Somers M.F., Hoekstra A.W. & Kroes G.J. (2012), Chebyshev high-dimensional model representation (Chebyshev-HDMR) potentials: application to reactive scattering of H-2 from Pt(111) and Cu(111) surfaces, PHYSICAL CHEMISTRY CHEMICAL PHYSICS 14(24): 8628-8643.artikel in tijdschrift (refereed)
  • Wijzenbroek M. & Somers M.F. (2012), Static surface temperature effects on the dissociation of H-2 and D-2 on Cu(111), Journal of Chemical Physics 137(5): 054703.artikel in tijdschrift (refereed)
  • Bonfanti M., Diaz C., Somers M.F. & Kroes G.J. (2011), Hydrogen dissociation on Cu(111): the influence of lattice motion. Part I, PHYSICAL CHEMISTRY CHEMICAL PHYSICS 13(10): 4552.artikel in tijdschrift (refereed)
  • Chen J.C., Juanes-Marcos J.C., Woittequand S., Somers M.F., Diaz C., Olsen R.A. & Kroes G.J. (2011), Six-dimensional quasiclassical and quantum dynamics of H(2) dissociation on the c(2 x 2)-Ti/Al(100) surface, Journal of Chemical Physics 134(11): 114708.artikel in tijdschrift (refereed)
  • Nieto P., Farias D., Miranda R., Luppi M., Baerends E.J., Somers M.F., van der Niet M.J.T.C., Olsen R.A. & Kroes G.J. (2011), Diffractive and reactive scattering of H(2) from Ru(0001): experimental and theoretical study, PHYSICAL CHEMISTRY CHEMICAL PHYSICS 13(18): 8583-8597.artikel in tijdschrift (refereed)
  • Groot I.M.N., Juanes-Marcos J.C., Diaz C., Somers M.F., Olsen R.A. & Kroes G.J. (2010), Dynamics of dissociative adsorption of hydrogen on a CO-precovered Ru(0001) surface: a comparison of theoretical and experimental results, PHYSICAL CHEMISTRY CHEMICAL PHYSICS 12(6): 1331-1340.artikel in tijdschrift (refereed)
  • Laurent G., Barredo D., Farias D., Miranda R., Diaz C., Riviere P., Somers M.F. & Martin F. (2010), Experimental and theoretical study of rotationally inelastic diffraction of D-2 from NiAl(110), Physical Chemistry Chemical Physics 12(43).artikel in tijdschrift (refereed)
  • Riviere P., Somers M.F., Kroes G.J. & Martin F. (2006), Quantum dynamical study of the H-2 and D-2 dissociative adsorption and diffraction from the NiAl (110) alloy surface, Physical Review B 73(20).artikel in tijdschrift (refereed)
  • Nave S., Lemoine D., Somers M.F., Kingma S.M. & Kroes G.J. (2005), Publisher's Note: "Six-dimensional quantum dynamics of (v=0, j=0)D-2 and of (v=1, j=0)H-2 scattering from Cu(111)" (vol 122, pg 214709, 2005), Journal of Chemical Physics 123(7).artikel in tijdschrift
  • Diaz C., Somers M.F., Kroes G.J., Busnengo H.F., Salin A. & Martin F. (2005), Quantum and classical dynamics of H-2 scattering from Pd(111) at off-normal incidence, Physical Review B : Condensed Matter 72(3).artikel in tijdschrift
  • Kroes G.J. & Somers M.F. (2005), Six-dimensional dynamics of dissociative chemisorption of H-2 on metal surfaces, Journal of Theoretical & Computational Chemistry 4(2): 493-581.artikel in tijdschrift
  • Nave S., Lemoine D., Somers M.F., Kingma S.M. & Kroes G.J. (2005), Six-dimensional quantum dynamics of (v=0,j=0)D-2 and of (v=1,j=0)H-2 scattering from Cu(111), Journal of Chemical Physics 122(21).artikel in tijdschrift
  • Diaz C., Busnengo H.F., Riviere P., Farias D., Nieto P., Somers M.F., Kroes G.J., Salin A. & Martin F. (2005), A classical dynamics method for H-2 diffraction from metal surfaces, Journal of Chemical Physics 122(15).artikel in tijdschrift
  • Kingma S.M., Somers M.F., Pijper E., Kroes G.J., Olsen R.A. & Baerends E.J. (2003), Diffractive and reactive scattering of (v=0, j=0)HD from Pt(111): six-dimensional quantum dynamics compared with experiment, Journal of Chemical Physics 118(9): 4190-4197.artikel in tijdschrift (refereed)
  • Kingma S.M., Somers M.F., Pijper E., Kroes G.J., Olsen R.A. & Baerends E.J. (2003), Diffractive and reactive scattering of (v=0, j=0) HD from Pt(111): Six-dimensional quantum dynamics compared with experiment, Journal of Chemical Physics 118: 4190-4197.artikel in tijdschrift (refereed)
  • Olsen R.A., Busnengo H.F., Salin A., Somers M.F., Kroes G.J. & Baerends E.J. (2002), Constructing accurate potential energy surfaces for a diatomic molecule interacting with a solid surface: H2 + Pt(111) and H2 + Cu(100), Journal of Chemical Physics 116: 3841.artikel in tijdschrift (refereed)
  • Busnengo H.F., Pijper E., Somers M.F., Kroes G.J., Salin A., Lemoine D. & Dong W. (2002), Six-dimensional quantum and classical dynamics study of H2 (v=0,j=0) scattering from Pd(111), Chemical Physics Letters 356: 515-522.artikel in tijdschrift (refereed)
  • Somers M.F., Kingma S.M., Pijper E., Kroes G.J. & Lemoine D. (2002), Six-dimensional quantum dynamics of scattering of (v=0,j=0) H2 from Cu(111); test of two LEPS potential energy surfaces, Chemical Physics Letters 360: 390-399.artikel in tijdschrift (refereed)
  • Somers M.F., McCormack D.A., Kroes G.J., Olsen R.A., Baerends E.J. & Mowrey R.C. (2002), Signatures of site-specific reaction of H2 on Cu(100), Journal of Chemical Physics 117: 6673-6687.artikel in tijdschrift (refereed)
  • Pijper E., Somers M.F., Kroes G.J., Baerends E.J., Olsen R.A., Busnengo H.F., Salin A. & Lemoine D. (2001), Six-dimensional quantum dynamics of scattering of (v=0, j=0) H2 from Pt(111): comparison to experiment and to classical dynamics results, Chemical Physics Letters 347: 277-284.artikel in tijdschrift (refereed)

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