Grönbeck H - Search Results

1

Interpretation of H₂-TPR from Cu-CHA Using First-Principles Calculations.

Bjerregaard JD, Han J, Creaser D, Olsson L, Grönbeck H. Bjerregaard JD, et al. Among authors: gronbeck h. J Phys Chem C Nanomater Interfaces. 2024 Mar 8;128(11):4525-4534. doi: 10.1021/acs.jpcc.3c07998. eCollection 2024 Mar 21. J Phys Chem C Nanomater Interfaces. 2024. PMID: 38533243 Free PMC article.

2

Vibrational analysis of H2 and D2 adsorption on Pt/SiO2.

Wallin M, Grönbeck H, Spetz AL, Eriksson M, Skoglundh M. Wallin M, et al. Among authors: gronbeck h. J Phys Chem B. 2005 May 19;109(19):9581-8. doi: 10.1021/jp044759z. J Phys Chem B. 2005. PMID: 16852153

3

Surface-Structure Libraries: Multifrequential Oscillations in Catalytic Hydrogen Oxidation on Rhodium.

Suchorski Y, Datler M, Bespalov I, Zeininger J, Stöger-Pollach M, Bernardi J, Grönbeck H, Rupprechter G. Suchorski Y, et al. Among authors: gronbeck h. J Phys Chem C Nanomater Interfaces. 2019 Feb 21;123(7):4217-4227. doi: 10.1021/acs.jpcc.8b11421. Epub 2019 Jan 23. J Phys Chem C Nanomater Interfaces. 2019. PMID: 31057690 Free PMC article.

4

A comparative test of different density functionals for calculations of NH₃-SCR over Cu-Chabazite.

Chen L, Janssens TVW, Grönbeck H. Chen L, et al. Among authors: gronbeck h. Phys Chem Chem Phys. 2019 Jun 7;21(21):10923-10930. doi: 10.1039/c9cp01576k. Epub 2019 May 15. Phys Chem Chem Phys. 2019. PMID: 31089628

5

Understanding the Phase Diagram of Self-Assembled Monolayers of Alkanethiolates on Gold.

Löfgren J, Grönbeck H, Moth-Poulsen K, Erhart P. Löfgren J, et al. Among authors: gronbeck h. J Phys Chem C Nanomater Interfaces. 2016 Jun 9;120(22):12059-12067. doi: 10.1021/acs.jpcc.6b03283. Epub 2016 May 12. J Phys Chem C Nanomater Interfaces. 2016. PMID: 27313813 Free PMC article.

6

Mechanism for NO2 charging on metal supported MgO.

Grönbeck H. Grönbeck H. J Phys Chem B. 2006 Jun 22;110(24):11977-81. doi: 10.1021/jp0616415. J Phys Chem B. 2006. PMID: 16800504

7

Structural, energetic, and vibrational properties of NO(x) adsorption on Ag(n), n = 1-8.

Grönbeck H, Hellman A, Gavrin A. Grönbeck H, et al. J Phys Chem A. 2007 Jul 12;111(27):6062-7. doi: 10.1021/jp071117d. Epub 2007 Jun 19. J Phys Chem A. 2007. PMID: 17579372

8

CO₂ adsorption on hydroxylated In₂O₃(110).

Posada-Borbón A, Grönbeck H. Posada-Borbón A, et al. Among authors: gronbeck h. Phys Chem Chem Phys. 2019 Oct 9;21(39):21698-21708. doi: 10.1039/c9cp04097h. Phys Chem Chem Phys. 2019. PMID: 31495842

9

Hydrogen adsorption on In₂O₃(111) and In₂O₃(110).

Posada-Borbón A, Grönbeck H. Posada-Borbón A, et al. Among authors: gronbeck h. Phys Chem Chem Phys. 2020 Jul 22;22(28):16193-16202. doi: 10.1039/d0cp01749c. Phys Chem Chem Phys. 2020. PMID: 32643732

10

The nature of NOx species on BaO(100): an ab initio molecular dynamics study.

Broqvist P, Panas I, Grönbeck H. Broqvist P, et al. Among authors: gronbeck h. J Phys Chem B. 2005 Aug 18;109(32):15410-6. doi: 10.1021/jp053178m. J Phys Chem B. 2005. PMID: 16852954

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