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1

The interpretation of XPS spectra: Insights into materials properties

Bagus, Paul S., Ilton, Eugene S., Nelin, Connie J.

Journal:

Surface Science Reports

Year:

2013

Language:

english

File:

PDF, 2.19 MB

english, 2013

2

A new analysis of X-ray adsorption branching ratios: Use of Russell–Saunders coupling

Paul S. Bagus, Hajo Freund, Helmut Kuhlenbeck, Eugene S. Ilton

Journal:

Chemical Physics Letters

Year:

2008

Language:

english

File:

PDF, 189 KB

english, 2008

3

XPS determination of uranium oxidation states

Eugene S. Ilton, Paul S. Bagus

Journal:

Surface and Interface Analysis

Year:

2011

Language:

english

File:

PDF, 754 KB

english, 2011

4

Theoretical modeling of the uranium 4f XPS for U(VI) and U(IV) oxides

Bagus, Paul S., Nelin, Connie J., Ilton, Eugene S.

Journal:

The Journal of Chemical Physics

Year:

2013

Language:

english

File:

PDF, 1.81 MB

english, 2013

5

Multiplet splitting for the XPS of heavy elements: Dependence on oxidation state

Bagus, Paul S., Nelin, Connie J., Al-Salik, Yahya, Ilton, Eugene S., Idriss, Hicham

Journal:

Surface Science

Year:

2015

Language:

english

File:

PDF, 1.32 MB

english, 2015

6

Covalent bonding in heavy metal oxides

Bagus, Paul S., Nelin, Connie J., Hrovat, Dave A., Ilton, Eugene S.

Journal:

The Journal of Chemical Physics

Year:

2017

Language:

english

File:

PDF, 649 KB

english, 2017

7

Quantifying small changes in uranium oxidation states using XPS of a shallow core level

Ilton, Eugene S., Du, Yingge, Stubbs, Joanne E., Eng, Peter J., Chaka, Anne M., Bargar, John R., Nelin, Connie J., Bagus, Paul S.

Journal:

Physical Chemistry Chemical Physics

Year:

2017

Language:

english

File:

PDF, 3.41 MB

english, 2017

8

Consequences of Realistic Embedding for the L 2,3 Edge XAS of  Fe 2 O 3

Bagus, Paul, Nelin, Connie J., Sassi, Michel, Ilton, Eugene S., Rosso, Kevin

Journal:

Physical Chemistry Chemical Physics

Year:

2018

Language:

english

File:

PDF, 1.12 MB

english, 2018

9

Extracting Chemical Information from XPS Spectra: A Perspective

Bagus, Paul S., Ilton, Eugene, Nelin, Connie J.

Journal:

Catalysis Letters

Year:

2018

Language:

english

File:

PDF, 1.32 MB

english, 2018

10

Atomic near-degeneracy for photoemission: Generality of 4f excitations

Paul S. Bagus, R. Broer, Eugene S. Ilton

Journal:

Journal of Electron Spectroscopy and Related Phenomena

Year:

2008

Language:

english

File:

PDF, 134 KB

english, 2008

11

A new near degeneracy effect for photoemission in transition metals

Paul S. Bagus, R. Broer, Eugene S. Ilton

Journal:

Chemical Physics Letters

Year:

2004

Language:

english

File:

PDF, 285 KB

english, 2004

12

A definitive analysis of the Rydberg and valence anti-bonding character of states in the O K-edge of H2O

Paul S. Bagus, Christof Wöll, Eugene S. Ilton

Journal:

Chemical Physics Letters

Year:

2006

Language:

english

File:

PDF, 279 KB

english, 2006

13

Beam induced reduction of U(VI) during X-ray photoelectron spectroscopy: The utility of the U4f satellite structure for identifying uranium oxidation states in mixed valence uranium oxides

Eugene S. Ilton, Jean-François Boily, Paul S. Bagus

Journal:

Surface Science

Year:

2007

Language:

english

File:

PDF, 970 KB

english, 2007

14

Atomic many-body effects in the 4f XPS of the U5+and U4+cations: part II: consequences of orbital relaxation

Paul S. Bagus, Eugene S. Ilton

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

2007

Language:

english

File:

PDF, 332 KB

english, 2007

15

Ligand field effects on the multiplet structure of the U4f XPS of UO2

Eugene S. Ilton, Paul S. Bagus

Journal:

Surface Science

Year:

2008

Language:

english

File:

PDF, 531 KB

english, 2008

16

Theory for the XPS of Actinides

Paul S. Bagus, Eugene S. Ilton

Journal:

Topics in Catalysis

Year:

2013

Language:

english

File:

PDF, 413 KB

english, 2013

17

Progress in Electronic and Vibrational Spectroscopy of Catalytic Materials and Catalytic Reactions: Theoretical and Experimental Studies

Hicham Idriss, Paul S. Bagus, Eugene S. Ilton

Journal:

Topics in Catalysis

Year:

2013

Language:

english

File:

PDF, 87 KB

english, 2013

18

Spin–orbit coupling in actinide cations

Bagus, Paul S., Ilton, Eugene S., Martin, Richard L., Jensen, Hans Jørgen Aa., Knecht, Stefan

Journal:

Chemical Physics Letters

Year:

2012

Language:

english

File:

PDF, 305 KB

english, 2012

19

Theoretical analysis of the U L3-edge NEXAFS in U oxides

Nelin, Connie J., Bagus, Paul S., Ilton, Eugene S.

Journal:

Year:

2014

Language:

english

File:

PDF, 434 KB

english, 2014

20

ions

Ilton, Eugene S., deJong, Wibe A., Bagus, Paul S.

Journal:

Physical Review B

Year:

2003

Language:

english

File:

PDF, 110 KB

english, 2003

21

free ions

Ilton, Eugene S., Bagus, Paul S.

Journal:

Physical Review B

Year:

2005

Language:

english

File:

PDF, 295 KB

english, 2005

22

-shell photoemission of transition metals:

Bagus, Paul S., Ilton, Eugene S.

Journal:

Physical Review B

Year:

2006

Language:

english

File:

PDF, 521 KB

english, 2006

23

photoelectron spectra of

Bagus, Paul S., Ilton, Eugene S., Rustad, James R.

Journal:

Physical Review B

Year:

2004

Language:

english

File:

PDF, 63 KB

english, 2004

24

The effect of symmetry on the U L3 NEXAFS of octahedral coordinated uranium(vi)

Bagus, Paul S., Nelin, Connie J., Ilton, Eugene S.

Journal:

The Journal of Chemical Physics

Year:

2017

Language:

english

File:

PDF, 1.26 MB

english, 2017

25

Analysis of X-ray adsorption edges: L 2,3 edge of FeCl 4−

Bagus, Paul S., Nelin, Connie J., Ilton, Eugene S., Sassi, Michel J., Rosso, Kevin M.

Journal:

The Journal of Chemical Physics

Year:

2017

Language:

english

File:

PDF, 2.70 MB

english, 2017

26

Analysis of the Fe 2p XPS for hematite α Fe 2 O 3 : Consequences of covalent bonding and orbital splittings on multiplet splittings

Bagus, Paul S., Nelin, Connie J., Brundle, C. R., Lahiri, N., Ilton, Eugene S., Rosso, Kevin M.

Journal:

The Journal of Chemical Physics

Year:

2020

File:

PDF, 1.76 MB

2020

27

A rigorous non-empirical theoretical analysis of the 2p XPS of NiO: Is it necessary to invoke nonlocal screening?

Bagus, Paul S., Brundle, C.R., Ilton, Eugene S.

Journal:

Journal of Electroanalytical Chemistry

Year:

2020

File:

PDF, 813 KB

2020