Wikfeldt KT - Search Results

1

Complementarity between high-energy photoelectron and L-edge spectroscopy for probing the electronic structure of 5d transition metal catalysts.

Anniyev T, Ogasawara H, Ljungberg MP, Wikfeldt KT, MacNaughton JB, Näslund LA, Bergmann U, Koh S, Strasser P, Pettersson LG, Nilsson A. Anniyev T, et al. Among authors: wikfeldt kt. Phys Chem Chem Phys. 2010 Jun 7;12(21):5694-700. doi: 10.1039/b926414k. Epub 2010 May 5. Phys Chem Chem Phys. 2010. PMID: 20442966

2

In situ X-ray probing reveals fingerprints of surface platinum oxide.

Friebel D, Miller DJ, O'Grady CP, Anniyev T, Bargar J, Bergmann U, Ogasawara H, Wikfeldt KT, Pettersson LG, Nilsson A. Friebel D, et al. Among authors: wikfeldt kt. Phys Chem Chem Phys. 2011 Jan 7;13(1):262-6. doi: 10.1039/c0cp01434f. Epub 2010 Nov 9. Phys Chem Chem Phys. 2011. PMID: 21063617

3

Spatially inhomogeneous bimodal inherent structure of simulated liquid water.

Wikfeldt KT, Nilsson A, Pettersson LG. Wikfeldt KT, et al. Phys Chem Chem Phys. 2011 Nov 28;13(44):19918-24. doi: 10.1039/c1cp22076d. Epub 2011 Sep 14. Phys Chem Chem Phys. 2011. PMID: 21915406

4

Wide-angle X-ray diffraction and molecular dynamics study of medium-range order in ambient and hot water.

Huang C, Wikfeldt KT, Nordlund D, Bergmann U, McQueen T, Sellberg J, Pettersson LG, Nilsson A. Huang C, et al. Among authors: wikfeldt kt. Phys Chem Chem Phys. 2011 Nov 28;13(44):19997-20007. doi: 10.1039/c1cp22804h. Epub 2011 Oct 19. Phys Chem Chem Phys. 2011. PMID: 22009343

5

Increasing correlation length in bulk supercooled H2O, D2O, and NaCl solution determined from small angle x-ray scattering.

Huang C, Weiss TM, Nordlund D, Wikfeldt KT, Pettersson LG, Nilsson A. Huang C, et al. Among authors: wikfeldt kt. J Chem Phys. 2010 Oct 7;133(13):134504. doi: 10.1063/1.3495974. J Chem Phys. 2010. PMID: 20942543 Free PMC article.

6

Ab initio van der waals interactions in simulations of water alter structure from mainly tetrahedral to high-density-like.

Møgelhøj A, Kelkkanen AK, Wikfeldt KT, Schiøtz J, Mortensen JJ, Pettersson LG, Lundqvist BI, Jacobsen KW, Nilsson A, Nørskov JK. Møgelhøj A, et al. Among authors: wikfeldt kt. J Phys Chem B. 2011 Dec 8;115(48):14149-60. doi: 10.1021/jp2040345. Epub 2011 Aug 1. J Phys Chem B. 2011. PMID: 21806000

7

Enhanced small-angle scattering connected to the Widom line in simulations of supercooled water.

Wikfeldt KT, Huang C, Nilsson A, Pettersson LG. Wikfeldt KT, et al. J Chem Phys. 2011 Jun 7;134(21):214506. doi: 10.1063/1.3594545. J Chem Phys. 2011. PMID: 21663366

8

On the range of water structure models compatible with X-ray and neutron diffraction data.

Wikfeldt KT, Leetmaa M, Ljungberg MP, Nilsson A, Pettersson LG. Wikfeldt KT, et al. J Phys Chem B. 2009 May 7;113(18):6246-55. doi: 10.1021/jp9007619. J Phys Chem B. 2009. PMID: 19358575

9

Diffraction and IR/Raman data do not prove tetrahedral water.

Leetmaa M, Wikfeldt KT, Ljungberg MP, Odelius M, Swenson J, Nilsson A, Pettersson LG. Leetmaa M, et al. Among authors: wikfeldt kt. J Chem Phys. 2008 Aug 28;129(8):084502. doi: 10.1063/1.2968550. J Chem Phys. 2008. PMID: 19044830

10

Oxygen-oxygen correlations in liquid water: addressing the discrepancy between diffraction and extended x-ray absorption fine-structure using a novel multiple-data set fitting technique.

Wikfeldt KT, Leetmaa M, Mace A, Nilsson A, Pettersson LG. Wikfeldt KT, et al. J Chem Phys. 2010 Mar 14;132(10):104513. doi: 10.1063/1.3330752. J Chem Phys. 2010. PMID: 20232977

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