Publications by authors named "Mark Somers"

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Reactive scattering of H2 on Cu(111) at 925 K: Effective Hartree potential vs sudden approximation.
Bauke Smits, Mantu Kumar Sah, Koushik Naskar, Satrajit Adhikari, Jörg Meyer, Mark F Somers

J Chem Phys· October 2024

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On the quantum dynamical treatment of surface vibrational modes for reactive scattering of H2 from Cu(111) at 925 K.
Mantu Kumar Sah, Koushik Naskar, Satrajit Adhikari, Bauke Smits, Jörg Meyer, Mark F Somers

J Chem Phys· July 2024

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Multicenter evaluation of the Selux Next-Generation Phenotyping antimicrobial susceptibility testing system.
Kristin R Baker, Kelly Flentie, Benjamin R Spears, Sergey Mozharov, Kristen Roberts, Mark Somers

J Clin Microbiol· January 2024

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Best-of-Both-Worlds Predictive Approach to Dissociative Chemisorption on Metals.
Andrew D Powell, Nick Gerrits, Theophile Tchakoua, Mark F Somers, Heriberto F Busnengo

J Phys Chem Lett· January 2024

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Constructing Mixed Density Functionals for Describing Dissociative Chemisorption on Metal Surfaces: Basic Principles.
Théophile Tchakoua, Tim Jansen, Youri van Nies, Rebecca F A van den Elshout, Bart A B van Boxmeer, Mark F Somers

J Phys Chem A· December 2023

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Simulating Highly Activated Sticking of H on Al(110): Quantum versus Quasi-Classical Dynamics.
Theophile Tchakoua, Andrew D Powell, Nick Gerrits, Mark F Somers, Katharina Doblhoff-Dier

J Phys Chem C Nanomater Interfaces· March 2023

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Effect of surface temperature on quantum dynamics of D on Cu(111) using a chemically accurate potential energy surface.
Joy Dutta, Koushik Naskar, Satrajit Adhikari, Jörg Meyer, Mark F Somers

J Chem Phys· November 2022

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Stopping molecular rotation using coherent ultra-low-energy magnetic manipulations.
Helen Chadwick, Mark F Somers, Aisling C Stewart, Yosef Alkoby, Thomas J D Carter

Nat Commun· April 2022

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Patterns of coping with work-related stress: A person-centred analysis with text data.
Mark John Somers, Jose Casal

Stress Health· April 2021

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Effect of surface temperature on quantum dynamics of H on Cu(111) using a chemically accurate potential energy surface.
Joy Dutta, Souvik Mandal, Satrajit Adhikari, Paul Spiering, Jörg Meyer, Mark F Somers

J Chem Phys· March 2021

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Defining the S1 Side of Glycosylation Reactions: Stereoselectivity of Glycopyranosyl Cations.
Thomas Hansen, Ludivine Lebedel, Wouter A Remmerswaal, Stefan van der Vorm, Dennis P A Wander, Mark Somers

ACS Cent Sci· May 2019

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Assessment of Two Problems of Specific Reaction Parameter Density Functional Theory: Sticking and Diffraction of H on Pt(111).
Elham N Ghassemi, Mark F Somers, Geert-Jan Kroes

J Phys Chem C Nanomater Interfaces· April 2019

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Transferability of the Specific Reaction Parameter Density Functional for H + Pt(111) to H + Pt(211).
Elham Nour Ghassemi, Egidius W F Smeets, Mark F Somers, Geert-Jan Kroes, Irene M N Groot

J Phys Chem C Nanomater Interfaces· February 2019

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Test of the Transferability of the Specific Reaction Parameter Functional for H + Cu(111) to D + Ag(111).
Elham Nour Ghassemi, Mark Somers, Geert-Jan Kroes

J Phys Chem C Nanomater Interfaces· October 2018

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A general method for controlling and resolving rotational orientation of molecules in molecule-surface collisions.
Oded Godsi, Gefen Corem, Yosef Alkoby, Joshua T Cantin, Roman V Krems, Mark F Somers

Nat Commun· May 2017

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Performance of a Non-Local van der Waals Density Functional on the Dissociation of H2 on Metal Surfaces.
Mark Wijzenbroek, David M Klein, Bauke Smits, Mark F Somers, Geert-Jan Kroes

J Phys Chem A· December 2015

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Chebyshev high-dimensional model representation (Chebyshev-HDMR) potentials: application to reactive scattering of H2 from Pt(111) and Cu(111) surfaces.
Phillip S Thomas, Mark F Somers, Anne W Hoekstra, Geert-Jan Kroes

Phys Chem Chem Phys· June 2012

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Dynamics of H2 dissociation on the 1/2 ML c(2 × 2)-Ti/Al(100) surface.
Jian-Cheng Chen, Maxi Ramos, Carina Arasa, Juan Carlos Juanes-Marcos, Mark F Somers

Phys Chem Chem Phys· March 2012

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Hydrogen dissociation on Cu(111): the influence of lattice motion. Part I.
Matteo Bonfanti, Cristina Díaz, Mark F Somers, Geert-Jan Kroes

Phys Chem Chem Phys· March 2011

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Six-dimensional quasiclassical and quantum dynamics of H2 dissociation on the c(2 × 2)-Ti/Al(100) surface.
Jian-Cheng Chen, Juan Carlos Juanes-Marcos, Sylvain Woittequand, Mark F Somers, Cristina Díaz

J Chem Phys· March 2011

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Experimental and theoretical study of rotationally inelastic diffraction of D2 from NiAl(110).
Guillaume Laurent, Daniel Barredo, Daniel Farías, Rodolfo Miranda, Cristina Díaz, Mark F Somers

Phys Chem Chem Phys· November 2010

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Marketing nursing as a profession: integrated marketing strategies to address the nursing shortage.
Mark John Somers, Linda Finch, Dee Birnbaum

Health Mark Q· July 2010

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Dynamics of dissociative adsorption of hydrogen on a CO-precovered Ru(0001) surface: a comparison of theoretical and experimental results.
Irene M N Groot, Juan Carlos Juanes-Marcos, Cristina Díaz, Mark F Somers, Roar A Olsen

Phys Chem Chem Phys· February 2010

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Stereodirecting effect of the pyranosyl C-5 substituent in glycosylation reactions.
Jasper Dinkelaar, Ana Rae de Jong, Robert van Meer, Mark Somers, Gerrit Lodder

J Org Chem· July 2009

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Six-dimensional quantum dynamics of (v=0,j=0)D2 and of (v=1,j=0)H2 scattering from Cu111.
Sven Nave, Didier Lemoine, Mark F Somers, Sikke M Kingma, Geert-Jan Kroes

J Chem Phys· June 2005

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