Author Shakouri, Khosrow
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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
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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
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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
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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
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