Author Kroes, Geert-Jan

• 2013 | Journal Article
  ​ ​Adiabatic Energy Loss in Hyperthermal H Atom Collisions with Cu and Au: A Basis for Testing the Importance of Nonadiabatic Energy Loss​
  Pavanello, M.; Auerbach, D. J.; Wodtke, A. M.; Blanco-Rey, M.; Alducin, M. & Kroes, G.-J.​ (2013) 
  The Journal of Physical Chemistry Letters, 4(21) pp. 3735​-3740​.​ DOI: https://doi.org/10.1021/jz401955r 
  ​Details  DOI  WoS 

• 2013 | Journal Article | 
  ​ ​Toward Detection of Electron-Hole Pair Excitation in H-atom Collisions with Au(111): Adiabatic Molecular Dynamics with a Semi-Empirical Full-Dimensional Potential Energy Surface​
  Janke, S. M.; Pavanello, M.; Kroes, G.-J.; Auerbach, D. J.; Wodtke, A. M. & Kandratsenka, A.​ (2013) 
  ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-INTERNATIONAL JOURNAL OF RESEARCH IN PHYSICAL CHEMISTRY & CHEMICAL PHYSICS, 227(9-11) pp. 1467​-1490​.​ DOI: https://doi.org/10.1524/zpch.2013.0411 
  ​Details  DOI  WoS 

• 2014 | Journal Article
  ​ ​Ab initio molecular dynamics calculations on scattering of hyperthermal H atoms from Cu(111) and Au(111)​
  Kroes, G.-J.; Pavanello, M.; Blanco-Rey, M.; Alducin, M. & Auerbach, D. J.​ (2014) 
  The Journal of Chemical Physics, 141(5) art. 054705​.​ DOI: https://doi.org/10.1063/1.4891483 
  ​Details  DOI  PMID  PMC  WoS 

• 2017 | Journal Article | 
  ​ ​Accurate Neural Network Description of Surface Phonons in Reactive Gas-Surface Dynamics: N-2 + Ru(0001)​
  Shakouri, K.; Behler, J. ; Meyer, J. & Kroes, G.-J.​ (2017) 
  The Journal of Physical Chemistry Letters, 8(10) pp. 2131​-2136​.​ DOI: https://doi.org/10.1021/acs.jpclett.7b00784 
  ​Details  DOI  PMID  PMC  WoS 

• 2018 | Journal Article | 
  ​ ​Analysis of Energy Dissipation Channels in a Benchmark System of Activated Dissociation: N2 on Ru(0001).​
  Shakouri, K.; Behler, J.; Meyer, J. & Kroes, G.-J.​ (2018) 
  The Journal of Physical Chemistry. C, Nanomaterials and Interfaces, 122(41) pp. 23470​-23480​.​ DOI: https://doi.org/10.1021/acs.jpcc.8b06729 
  ​Details  DOI  PMID  PMC 

• 2019 | Journal Article | 
  ​ ​Accurate Probabilities for Highly Activated Reaction of Polyatomic Molecules on Surfaces Using a High-Dimensional Neural Network Potential: CHD 3 + Cu(111)​
  Gerrits, N.; Shakouri, K.; Behler, J. & Kroes, G.-J.​ (2019) 
  The Journal of Physical Chemistry Letters, 10(8) pp. 1763​-1768​.​ DOI: https://doi.org/10.1021/acs.jpclett.9b00560 
  ​Details  DOI  PMID  PMC 

• 2019 | Journal Article | 
  ​ ​Orbital-Dependent Electronic Friction Significantly Affects the Description of Reactive Scattering of N 2 from Ru(0001)​
  Spiering, P.; Shakouri, K.; Behler, J.; Kroes, G.-J. & Meyer, J.​ (2019) 
  The Journal of Physical Chemistry Letters, 10(11) pp. 2957​-2962​.​ DOI: https://doi.org/10.1021/acs.jpclett.9b00523 
  ​Details  DOI  PMID  PMC 

• 2020 | Journal Article
  ​ ​Closing the Gap Between Experiment and Theory: Reactive Scattering of HCl from Au(111)​
  Gerrits, N.; Geweke, J.; Smeets, E. W. F.; Voss, J.; Wodtke, A. M.   & Kroes, G.-J.​ (2020) 
  The Journal of Physical Chemistry C, 124(29) pp. 15944​-15960​.​ DOI: https://doi.org/10.1021/acs.jpcc.0c03756 
  ​Details  DOI 

• 2021 | Journal Article
  ​ ​Highly Efficient Activation of HCl Dissociation on Au(111) via Rotational Preexcitation​
  Gerrits, N.; Geweke, J.; Auerbach, D. J.; Beck, R. D. & Kroes, G.-J.​ (2021) 
  The Journal of Physical Chemistry Letters, 12(30) pp. 7252​-7260​.​ DOI: https://doi.org/10.1021/acs.jpclett.1c02093 
  ​Details  DOI 

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