Oxygen

Doublet Separations

  • No relevant non-S-orbital emissions

The Energies Listed are Binding Energies!

 

  • O 1s: 530 eV
  • O 2s: 20 eV
  • O 2p: 8 eV
XPS of a Water Droplet on Au
XPS survey scan of H2O frozen on an Au foil (recorded at 140K).

The Energies Listed are Binding Energies!

Overlaps for O 1s (primary emission)

  • Na KLL (Al kα X-rays) (500 eV)
  • V 2p (512 eV)
  • Dy MNN (Al kα X-rays) (517 eV)
  • Sb 3d (528 eV)
  • Pd 3d (531 eV)
  • At 4d (533 eV)
O 1s XPS spectrum
O 1s Peak overlap markers. Note – Na KLL not shown, but some auger intensity will overlap with the high binding energy side of O 1s.

Energies listed are Kinetic Energies!

 

O KLL: ~ 505 eV

 

O KLL Auger
O KLL Auger emission for frozen water droplet on Au foil.

The Energies Listed are Binding Energies!

Species Binding energy range / eV
Metal Oxides 529-531
Metal Carbonates 532-532
Organic C-O ~533
Organic C=O 531-532
Hydroxyls/Hydroxides 532-533
Common Oxygen Binding Energies

For a detailed list of metal oxide O 1s positions, check out our page on Oxygen (Metal Oxides) and Oxygen (Organics and Polymers)

Oxygen is generally analysed using the O 1s region, which is a typical symmetric Gaussian with no particularly unusual features.

The O 1s core level is particularly significant in XPS analysis because it provides detailed information about the chemical states of oxygen atoms. The binding energy of the O 1s electrons varies depending on the specific chemical environment, allowing for the identification of different oxygen-containing species such as oxides, hydroxides, carbonates, and organic oxygen compounds. Accurate interpretation of the O 1s spectra requires careful consideration of factors such as sample preparation, charge neutralization, and peak fitting, as the O 1s region can be complex with overlapping peaks from different oxygen species.

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If depth profiling metal oxides, be aware that aggressive ion etching treatments will preferentially remove oxygen. Collect the oxygen first for each scan.

 

Recording an extended range (~580 eV), permits recording of the O 1s loss feature, caused by inelastically scattered electrons – and may be used to measure material band gaps.

 

If a significant amount of sodium is present, be sure to record at energies up to around 540 eV, as a lower level Auger emission from the Na KLL transition will present as spectral intensity at the high binding energy side – which will need a larger range for correct background modelling.

Oxygen analysed in the presence of Na may result in confusion with some lower order signal intensity from the Na KLL Auger transition – appearing as high energy Oxygen. This may be particularly confusing if analysing O 1s species at very high BE (e.g. water in NAP-XPS), where the Na intensity may seem to be a shoulder of the main peak. O 1s + Na KLL

Overlap between O 1s and Na KLL signal – note this Na KLL intensity may be mistaken for high energy O 1s features

Not available

References

  1. Data acquired by HarwellXPS
  2. Isaacs, Mark A. “Low temperature XPS of sensitive molecules: Titanium butoxide photoelectron spectra.” Applied Surface Science Advances 18 (2023): 100467. Read it online here.
  3. Isaacs, Mark A., Brunella Barbero, Lee J. Durndell, Anthony C. Hilton, Luca Olivi, Christopher MA Parlett, Karen Wilson, and Adam F. Lee. “Tunable silver-functionalized porous frameworks for antibacterial applications.” Antibiotics 7, no. 3 (2018): 55. Read it online here.
  4. Montero, Janine M., Pratibha Gai, Karen Wilson, and Adam F. Lee. “Structure-sensitive biodiesel synthesis over MgO nanocrystals.” Green chemistry 11, no. 2 (2009): 265-268. Read it online here.

Oxygen (Metal Oxides)

Learn about Oxygen XPS Analysis of Metal Oxide Systems

Oxygen (Organics and Polymers)

Learn about Oxygen XPS Analysis of Metal Oxide Systems