The carbon 1s photoelectron spectrum is the most widely fit and analyzed narrow scan in the x-ray photoelectron spectroscopy (XPS) literature. It is, therefore, critically important to adopt well-established protocols based on best practices for its analysis, since results of these efforts affect research outcomes in a wide range of different application areas across materials science. Unfortunately, much XPS peak fitting in the scientific literature is inaccurate. In this guide, we describe and explain the most common problems associated with C 1s narrow scan analysis in the XPS literature. We then provide an overview of rules, principles, and considerations that, taken together, should guide the approach to the analysis of C 1s spectra. We propose that following this approach should result in (1) the avoidance of common problems and (2) the extraction of reliable, reproducible, and meaningful information from experimental data.

1.
D. R.
Baer
 et al.,
J. Vac. Sci. Technol. A
38
,
031204
(
2020
).
2.
G. H.
Major
 et al.,
J. Vac. Sci. Technol. A
38
,
061204
(
2020
).
3.
D. R.
Baer
and
I. S.
Gilmore
,
J. Vac. Sci. Technol. A
36
,
068502
(
2018
).
6.
M. R.
Linford
 et al.,
Microsc. Microanal.
26
,
1
(
2020
).
7.
D. R.
Baer
 et al.,
J. Vac. Sci. Technol. A
37
,
031401
(
2019
).
8.
Special Topic Collection: Reproducibility Challenges and Solutions, J. Vac. Sci. Technol. A (2020), see https://avs.scitation.org/topic/special-collections/reprod2020?SeriesKey=jva
9.
F. A.
Stevie
and
C. L.
Donley
,
J. Vac. Sci. Technol. A
38
,
063204
(
2020
).
10.
G.
Beamson
and
D.
Briggs
,
High Resolution XPS of Organic Polymers the Scienta ESCA300 Database
(
Wiley
,
Chichester
,
1992
).
11.
C. D.
Easton
,
C.
Kinnear
,
S. L.
McArthur
, and
T. R.
Gengenbach
,
J. Vac. Sci. Technol. A
38
,
023207
(
2020
).
12.
F. A.
Stevie
,
R.
Garcia
,
J.
Shallenberger
,
J. G.
Newman
, and
C. L.
Donley
,
J. Vac. Sci. Technol. A
38
,
063202
(
2020
).
13.
D. I.
Patel
,
S.
Noack
,
C. D.
Vacogne
,
H.
Schlaad
,
S.
Bahr
,
P.
Dietrich
,
M.
Meyer
,
A.
Thißen
, and
M. R.
Linford
,
Surf. Sci. Spectra
26
,
024004
(
2019
).
14.
A.
Naumkin
,
A.
Kraut-Vass
,
S.
Gaarenstroom
, and
C.
Powell
, NIST X-ray Photoelectron Spectroscopy Database, NIST Standard Reference Database Number 20 (National Institute of Standards and Technology, Gaithersburg, MD, 2000).
15.
D. R.
Baer
,
C. F.
Windisch
,
M. H.
Engelhard
, and
K. R.
Zavadil
,
J. Surf. Anal.
9
,
396
(
2002
).
16.
D. I.
Patel
 et al.,
Surf. Sci. Spectra
26
,
016801
(
2019
).
17.
T. G.
Avval
,
S.
Chatterjee
,
S.
Bahr
,
P.
Dietrich
,
M.
Meyer
,
A.
Thißen
, and
M. R.
Linford
,
Surf. Sci. Spectra
26
,
014022
(
2019
).
18.
V.
Jain
 et al.,
Surf. Sci. Spectra
26
,
024010
(
2019
).
19.
D. S.
Jensen
 et al.,
Surf. Interface Anal.
45
,
1273
(
2013
).
20.
A. M.
Spool
,
The Practice of TOF-SIMS: Time of Flight Secondary Ion Mass Spectrometry
(
Momentum Press
,
New York
,
2016
).
21.
S.
Fearn
,
An Introduction to Time-of-Flight Secondary Ion Mass Spectrometry (ToF-SIMS) and Its Application to Materials Science
(
Morgan & Claypool
,
San Rafael, CA
,
2015
).
22.
J.
Wolstenholme
,
Auger Electron Spectroscopy: Practical Application to Materials Analysis and Characterization of Surfaces, Interfaces, and Thin Films
(
Momentum Press
,
New York
,
2015
).
23.
G. G.
Hoffmann
,
Raman Spectroscopy, Volume I: Principles and Applications in Chemistry, Physics, Materials Science, and Biology
(
Momentum Press
,
New York
,
2019
).
24.
H. G.
Tompkins
and
J. N.
Hilfiker
,
Spectroscopic Ellipsometry: Practical Application to Thin Film Characterization
(
Momentum
,
New York
,
2015
).
25.
H.
Fujiwara
,
Spectroscopic Ellipsometry: Principles and Applications
(
John Wiley & Sons
, Hoboken,
2007
).
26.
ASTM E1523-15
,
Standard Guide to Charge Control and Charge Referencing Techniques in X-Ray Photoelectron Spectroscopy
(
ASTM International
,
West Conshohocken
,
2015
).
27.
ISO 19318:2004
, Surface chemical analysis—X-ray photoelectron spectroscopy—Reporting of methods used for charge control and charge correction, International Organization for Standardization, Geneva, 2004.
28.
G.
Greczynski
and
L.
Hultman
,
Prog. Mater. Sci.
107
,
100591
(
2020
).
29.
V.
Jain
,
M. C.
Biesinger
, and
M. R.
Linford
,
Appl. Surf. Sci.
447
,
548
(
2018
).
30.
T.
Susi
,
T.
Pichler
, and
P.
Ayala
,
Beilstein J. Nanotechnol.
6
,
177
(
2015
).
31.
R.
Blume
,
D.
Rosenthal
,
J. P.
Tessonnier
,
H.
Li
,
A.
Knop-Gericke
, and
R.
Schlögl
,
ChemCatChem
7
,
2871
(
2015
).
32.
D. S.
Jensen
,
S. S.
Kanyal
,
N.
Madaan
,
M. A.
Vail
,
A. E.
Dadson
,
M. H.
Engelhard
, and
M. R.
Linford
,
Surf. Sci. Spectra
20
,
62
(
2013
).
33.
G. H.
Major
,
D.
Shah
,
V.
Fernandez
,
N.
Fairley
, and
M. R.
Linford
,
Vac. Tech. Coat.
21
,
43
46
(
2020
).
34.
G. H.
Major
,
D.
Shah
,
V.
Fernandez
,
N.
Fairley
, and
M. R.
Linford
,
Vac. Tech. Coat.
21
,
35
39
(
2020
).
35.
S.
Doniach
and
M.
Sunjic
,
J. Phys. C Solid State Phys.
3
,
285
(
1970
).
36.
H.
Ganegoda
,
D. S.
Jensen
,
D.
Olive
,
L.
Cheng
,
C. U.
Segre
,
M. R.
Linford
, and
J.
Terry
,
J. Appl. Phys.
111
,
053705
(
2012
).
37.
G. H.
Major
,
N.
Fairley
,
P. M.
Sherwood
,
M. R.
Linford
,
J.
Terry
,
V.
Fernandez
, and
K.
Artyushkova
,
J. Vac. Sci. Technol. A
38
, 061203 (
2020
).
38.
B.
Singh
,
R.
Hesse
, and
M. R.
Linford
,
Vac. Tech. Coat.
12
,
25
31
(
2015
).
39.
B.
Singh
,
A.
Herrera-Gomez
,
J.
Terry
, and
M. R.
Linford
,
Vac. Tech. Coat.
17
,
24
27
(
2016
).
40.
P. M. A.
Sherwood
,
Surf. Interface Anal.
51
,
589
(
2019
).
41.
P. M. A.
Sherwood
,
J. Vac. Sci. Technol. A
14
,
1424
(
1996
).
42.
J.
Matthew
,
D.
Briggs
, and
J. T.
Grant
,
Surface Analysis by Auger and X-Ray Photoelectron Spectroscopy
(
IMPublications
,
Chichester
,
2004
).
43.
B.
Singh
,
A.
Diwan
,
V.
Jain
,
A.
Herrera-Gomez
,
J.
Terry
, and
M. R.
Linford
,
Appl. Surf. Sci.
387
,
155
(
2016
).
44.
E. S.
Mark Greiner
,
John
Walton
,
David
Morgan
,
Vincent
Fernandez
,
Jonas
Baltrusaitis
, and
Neal
Fairley
, “
A guide to fitting XPS data with peaks
,”
J. Vac. Sci. Technol. A
(unpublished).
45.
D. R.
Baer
and
A. G.
Shard
,
J. Vac. Sci. Technol. A
38
,
031203
(
2020
).
46.
R. N.
Bracewell
,
The Fourier Transform and Its Applications
, 3rd ed. (
McGraw-Hill
,
New York
,
1999
).
47.
J. E.
Castle
,
Surf. Interface Anal.
33
,
196
(
2002
).
48.
A. S.
Lea
,
K. R.
Swanson
,
J. N.
Haack
,
J. E.
Castle
,
S.
Tougaard
, and
D. R.
Baer
,
Surf. Interface Anal.
42
,
1061
(
2010
).
49.
M.
Correll
and
J.
Heer
, paper presented at the Proceedings of the 2017 CHI Conference on Human Factors in Computing Systems, Denver, 2 May 2017.
50.
D. I.
Patel
,
A.
Matic
,
H.
Schlaad
,
S.
Bahr
,
P.
Dietrich
,
M.
Meyer
, and
A.
Thißen
,
Surf. Sci. Spectra
27
,
014005
(
2020
).
51.
T.
Roychowdhury
,
S.
Bahr
,
P.
Dietrich
,
M.
Meyer
,
A.
Thißen
, and
M. R.
Linford
,
Surf. Sci. Spectra
26
,
014018
(
2019
).
52.
D.
Shah
,
D. I.
Patel
,
T.
Roychowdhury
,
G. B.
Rayner
,
N.
O’Toole
,
D. R.
Baer
, and
M. R.
Linford
,
J. Vac. Sci. Technol. B
36
,
062902
(
2018
).
53.
G. H.
Major
,
T. G.
Avval
,
N.
Fairley
, and
M. R.
Linford
,
Vac. Tech. Coat.
21
,
37
40
(
2020
).
54.
M. H.
Engelhard
,
D. R.
Baer
,
A.
Herrera-Gomez
, and
P. M.
Sherwood
,
J. Vac. Sci. Technol. A
38
,
063203
(
2020
).
55.
S.
Tougaard
,
J. Vac. Sci. Technol. A
39
,
011201
(
2021
).
56.
G. H. Major, T. G. Avval, D. I. Patel, D. Shah, T. Roychowdhury, A. J. Barlow, P. J. Pigram, M. Greiner, V. Fernandez, A. Herrera-Gomez, N. Fairley, and M. R. Linford, “
Practical guides for x-ray photoelectron spectrsocopy (XPS): Synthetic line shapes for fitting asymmetric signals
,”
J. Vac. Sci. Technol. A
(submitted).
57.
M. C.
Biesinger
,
L. W.
Lau
,
A. R.
Gerson
, and
R. S. C.
Smart
,
Appl. Surf. Sci.
257
,
887
(
2010
).
58.
D. A.
Beattie
,
A.
Arcifa
,
I.
Delcheva
,
B. A.
Le Cerf
,
S. V.
MacWilliams
,
A.
Rossi
, and
M.
Krasowska
,
Colloids Surf. A
544
,
78
(
2018
).
59.
Q.
Liu
,
Y.
Han
,
J.
Cai
,
E. J.
Crumlin
,
Y.
Li
, and
Z.
Liu
,
Catal. Lett.
148
,
1686
(
2018
).
60.
American Vacuum Society, see https://avs.scitation.org/journal/sss for “Surface Science Spectra.”
61.
P. R.
Davies
and
D. J.
Morgan
,
J. Vac. Sci. Technol. A
38
,
033204
(
2020
).
62.
A. G.
Shard
,
J. Vac. Sci. Technol. A
38
,
041201
(
2020
).
63.
C. R.
Brundle
and
B. V.
Crist
,
J. Vac. Sci. Technol. A
38
,
041001
(
2020
).
64.
J.
Wolstenholme
,
J. Vac. Sci. Technol. A
38
,
043206
(
2020
).
65.
T. G.
Avval
,
G. T.
Hodges
,
J.
Wheeler
,
D. H.
Ess
,
S.
Bahr
,
P.
Dietrich
,
M.
Meyer
,
A.
Thißen
, and
M. R.
Linford
,
Surf. Sci. Spectra
27
,
014006
(
2020
).
66.
T.
Roychowdhury
,
S.
Bahr
,
P.
Dietrich
,
M.
Meyer
,
A.
Thißen
, and
M. R.
Linford
,
Surf. Sci. Spectra
26
,
014015
(
2019
).
67.
V.
Gupta
,
H.
Ganegoda
,
M. H.
Engelhard
,
J.
Terry
, and
M. R.
Linford
,
J. Chem. Educ.
91
,
232
(
2014
).
68.
N.
Fairley
, in
Surface Analysis by Auger and X-Ray Photoelectron Spectroscopy
, edited by
D.
Briggs
and
J. T.
Grant
(
IMPublications
,
Chichester
,
2004
), p.
1647
.
69.
S.
Tardio
and
P. J.
Cumpson
,
Surf. Interface Anal.
50
,
5
(
2018
).
70.
J.
Zhao
,
F.
Gao
,
S. P.
Pujari
,
H.
Zuilhof
, and
A. V.
Teplyakov
,
Langmuir
33
,
10792
(
2017
).
71.
B.
Singh
,
D.
Velázquez
,
J.
Terry
, and
M. R.
Linford
,
J. Electron Spectrosc. Relat. Phenom.
197
,
112
(
2014
).
72.
V.
Jain
,
S.
Bahr
,
P.
Dietrich
,
M.
Meyer
,
A.
Thißen
, and
M. R.
Linford
,
Surf. Sci. Spectra
26
,
014028
(
2019
).
73.
S.
Chatterjee
,
B.
Singh
,
A.
Diwan
,
Z. R.
Lee
,
M. H.
Engelhard
,
J.
Terry
,
H. D.
Tolley
,
N. B.
Gallagher
, and
M. R.
Linford
,
Appl. Surf. Sci.
433
,
994
(
2018
).
74.
J. N.
Hilfiker
,
N.
Singh
,
T.
Tiwald
,
D.
Convey
,
S. M.
Smith
,
J. H.
Baker
, and
H. G.
Tompkins
,
Thin Solid Films
516
,
7979
(
2008
).
75.
D.
Shah
,
S.
Bahr
,
P.
Dietrich
,
M.
Meyer
,
A.
Thißen
, and
M. R.
Linford
,
Surf. Sci. Spectra
26
,
024009
(
2019
).
76.
M. R.
Anisur
,
P. C.
Banerjee
,
C. D.
Easton
, and
R. K. S.
Raman
,
Carbon
127
,
131
(
2018
).
77.
M.
Sharifzadeh Mirshekarloo
 et al.,
ACS Sustain. Chem. Eng.
8
,
1031
(
2019
).
78.
D. J.
Eyckens
,
C. L.
Arnold
,
Ž
Simon
,
T. R.
Gengenbach
,
J.
Pinson
,
Y. A.
Wickramasingha
, and
L. C.
Henderson
, “
Covalent sizing surface modification as a route to improved interfacial adhesion in carbon fiber-epoxy composites
,” Compos. Part A Appl. S. (submitted).
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