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Leygraf, ChristopherORCID iD iconorcid.org/0000-0002-9453-1333
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Publications (10 of 260) Show all publications
Göthelid, M., Götelid, S. A., Hosseinpour, S., Leygraf, C. & Johnson, C. M. (2025). Co-Adsorption of Formic Acid and Hexane Selenol on Cu. Corrosion and Materials Degradation, 6(4), Article ID 48.
Open this publication in new window or tab >>Co-Adsorption of Formic Acid and Hexane Selenol on Cu
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2025 (English)In: Corrosion and Materials Degradation, E-ISSN 2624-5558, Vol. 6, no 4, article id 48Article in journal (Refereed) Published
Abstract [en]

Self-assembled monolayers of alkane thiolate and alkane selenolate have been proven to inhibit atmospheric corrosion, but upon prolonged exposure to the important constituents of indoor atmosphere, namely humidified air with formic acid, the protective layer eventually breaks, but the exact reason is not yet clear. In this paper, we report on an XPS study of co-adsorbed formic acid and hexane selenol on a Cu surface. Adsorption of hexane selenol at room temperature breaks the Se-C bond, leaving a monolayer of Se on the surface, whereas adsorption at 140 K leaves a layer of selenolate. Formic acid exposure to the selenolate-Cu surface leads to adsorbed formate on unprotected areas and absorption of formic acid within the alkane chain network. During heating, the formic acid desorbs and the Se-C bond breaks, but formic acid does not accelerate the Se-C scission, which occurs just below room temperature both with and without formic acid. Thus, formic acid alone does not affect the Se-C bond, but its presence may create disorder and open up the alkane carpet for other species. Selenol removes formate and oxide from the surface at room temperature. The Se-C bond breaks and the alkane chain reacts with surface oxygen to form carbon oxides and volatile hydrocarbons.

Place, publisher, year, edition, pages
MDPI AG, 2025
Keywords
copper, corrosion protection, formic acid, hexane selenol, XPS
National Category
Chemical Sciences
Identifiers
urn:nbn:se:kth:diva-374962 (URN)10.3390/cmd6040048 (DOI)001646215200001 ()2-s2.0-105025881987 (Scopus ID)
Note

QC 20260112

Available from: 2026-01-12 Created: 2026-01-12 Last updated: 2026-01-12Bibliographically approved
Zhang, B., Lei, X., Huang, F., Chang, H., Pu, S., Jin, Y. & Leygraf, C. (2025). Study of the effect of H3BO3 concentration and temperature on the corrosion behavior of B4C/6061Al. NPJ Materials Degradation, 9(1), Article ID 84.
Open this publication in new window or tab >>Study of the effect of H3BO3 concentration and temperature on the corrosion behavior of B4C/6061Al
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2025 (English)In: NPJ Materials Degradation, ISSN 2397-2106, Vol. 9, no 1, article id 84Article in journal (Refereed) Published
Abstract [en]

The corrosion behavior of B4C/6061Al in spent nuclear fuel (SNF) storage environments was investigated in H3BO3 solutions (0-10,000 ppm) at temperatures ranging from 20 degrees C to 90 degrees C by using experimental and computational approaches. The results reveal that dispersed B4C particles act as cathodes, accelerating the dissolution of the aluminum matrix rather than causing localized trench formation. In deionized water, a dual-layered protective corrosion product film forms, consisting of an inner gamma-AlOOH layer and an outer Al(OH)(3) layer. H3BO3 dissolves both the aluminum matrix and its corrosion products in the following order: Al(OH)(3) > gamma-AlOOH > aluminum matrix, with increasing effect at higher concentrations. Elevated temperatures enhance both the formation of corrosion products and the dissolution rate by H+. Overall, the results suggest that B4C/6061Al exhibits high corrosion resistance in deionized water (BWR conditions) but suffers significant degradation in H3BO3-containing pools (PWR conditions).

Place, publisher, year, edition, pages
Springer Nature, 2025
National Category
Chemical Sciences
Identifiers
urn:nbn:se:kth:diva-371478 (URN)10.1038/s41529-025-00636-0 (DOI)001524876900002 ()2-s2.0-105010175991 (Scopus ID)
Note

QC 20251030

Available from: 2025-10-30 Created: 2025-10-30 Last updated: 2025-10-30Bibliographically approved
Chang, T., Leygraf, C., Herting, G., Fan, Y., Babu, P., Malkoch, M., . . . Odnevall, I. (2024). Effect of blue light illumination on atmospheric corrosion and bacterial adhesion on copper. Corrosion Science, 230, Article ID 111909.
Open this publication in new window or tab >>Effect of blue light illumination on atmospheric corrosion and bacterial adhesion on copper
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2024 (English)In: Corrosion Science, ISSN 0010-938X, E-ISSN 1879-0496, Vol. 230, article id 111909Article in journal (Refereed) Published
Abstract [en]

The effect of blue light on atmospheric corrosion of Cu and on the antimicrobial properties was explored upon exposure mimicking the condition of hygienic surface disinfection. The results show that blue light illumination enhanced the formation of Cu2O, resulting in a slightly increased corrosion resistance of Cu without pre-deposited NaCl, whereas the enhanced formation of Cu2O, CuCl and/or Cu(OH)3Cl on copper with pre-deposited NaCl caused concomitant corrosion product flaking and a reduced corrosion resistance. The blue light induced enhancement of Cu corrosion led to increased surface roughness and more pronounced integration of bacteria within the corrosion products.

Place, publisher, year, edition, pages
Elsevier BV, 2024
Keywords
Atmospheric corrosion, Bacteria (E. coli), Blue light, Chloride, Copper
National Category
Surface- and Corrosion Engineering
Identifiers
urn:nbn:se:kth:diva-343995 (URN)10.1016/j.corsci.2024.111909 (DOI)001185810700001 ()2-s2.0-85185492077 (Scopus ID)
Note

QC 20240229

Available from: 2024-02-28 Created: 2024-02-28 Last updated: 2025-02-09Bibliographically approved
Chen, S., Liu, M., Leygraf, C., Huang, F., Fan, L., Ma, L. & Jin, Y. (2024). First-principles analysis of the stability and hydrogen adsorption properties of the α-Ti/α2-Ti3Al interface towards clarified hydrogen embrittlement mechanism of titanium alloys. International journal of hydrogen energy, 72, 338-348
Open this publication in new window or tab >>First-principles analysis of the stability and hydrogen adsorption properties of the α-Ti/α2-Ti3Al interface towards clarified hydrogen embrittlement mechanism of titanium alloys
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2024 (English)In: International journal of hydrogen energy, ISSN 0360-3199, E-ISSN 1879-3487, Vol. 72, p. 338-348Article in journal (Refereed) Published
Abstract [en]

First-principles calculations were employed to investigate the adsorption and diffusion energy of hydrogen (H) in the Ti/Ti3Al binary system, along with the evolution of the interfacial stability induced by the presence of H. The penetration energy barrier indicates that H can more easily penetrate the substrate through the Ti/Ti3Al interface. The formation energy of H increases with distance from the interface and the Ti/Ti3Al interface acts as a sink for trapping hydrogen interstitials. When all interstitial sites are completely occupied by H, the cleavage energy along the interface decreases from 1.935 to 1.094 J/m2, suggesting that H doping significantly reduces the strength of the Ti-Ti3Al (01–10) interface. When the area density of H-doping at the interface exceeds 0.37 atoms/Å2, the α-Ti lattice expands. Consistent with experimental observations, this triggers atomic migration and the generation of Ti-hydrides. Further analysis of the atomic structure and Bader charge transfers indicate that the interaction of Ti and H can alter the localized electronic structure of Al, leading to a weakened interface due to loss of interface bond strength. In summary, the theoretical calculations have provided new insights into possible hydrogen embrittlement (HE) mechanism in titanium alloys.

Place, publisher, year, edition, pages
Elsevier BV, 2024
Keywords
Corrosion, DFT, HE, Hydrogen-embrittlement, Titanium
National Category
Condensed Matter Physics
Identifiers
urn:nbn:se:kth:diva-347289 (URN)10.1016/j.ijhydene.2024.05.173 (DOI)001247170100001 ()2-s2.0-85194294972 (Scopus ID)
Note

QC 20240704

Available from: 2024-06-10 Created: 2024-06-10 Last updated: 2024-07-04Bibliographically approved
Ratia-Hanby, V., Isotahdon, E., Yue, X., Malmberg, P., Leygraf, C., Pan, J. & Huttunen-Saarivirta, E. (2023). Characterization of surface films that develop on pre-oxidized copper in anoxic simulated groundwater with sulphide. Colloids and Surfaces A: Physicochemical and Engineering Aspects, 676, Article ID 132214.
Open this publication in new window or tab >>Characterization of surface films that develop on pre-oxidized copper in anoxic simulated groundwater with sulphide
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2023 (English)In: Colloids and Surfaces A: Physicochemical and Engineering Aspects, ISSN 0927-7757, E-ISSN 1873-4359, Vol. 676, article id 132214Article in journal (Refereed) Published
Abstract [en]

Surface films formed on pre-oxidized copper in anoxic simulated groundwater with sulphide were characterized by field emission gun scanning electron microscopy (FEG-SEM), Fourier transform infrared spectroscopy (FT-IR), open circuit potential (OCP) measurements, and via analysing the water chemistry and weight changes in the specimens. Additionally, films developed under identical conditions on pre-oxidized and ground copper specimens were characterized by glow discharge optical emission spectroscopy (GDOES). The results revealed that the sulphide content in the groundwater significantly influences the morphology, composition and thickness of the surface film. The build-up of Cu2S was evidenced at the sulphide contents of 32 mg/L and 320 mg/L. GDOES depth profiling revealed that sulphur and oxygen coexisted in the film all through its thickness, yet the surface was essentially rich in sulphur. The results from characterization are presented in detail in this paper and discussed from the perspective of capabilities of the used methods.

Place, publisher, year, edition, pages
Elsevier BV, 2023
Keywords
Copper, Copper sulphide, Cuprous oxide, Surface film, Thickness
National Category
Surface- and Corrosion Engineering
Identifiers
urn:nbn:se:kth:diva-334957 (URN)10.1016/j.colsurfa.2023.132214 (DOI)001073107900001 ()2-s2.0-85167968531 (Scopus ID)
Note

QC 20230830

Available from: 2023-08-30 Created: 2023-08-30 Last updated: 2025-02-09Bibliographically approved
Yue, X., Malmberg, P., Isotahdon, E., Ratia-Hanby, V., Huttunen-Saarivirta, E., Leygraf, C. & Pan, J. (2023). Penetration of corrosive species into copper exposed to simulated O2-free groundwater by time-of-flight secondary ion mass spectrometry (ToF-SIMS). Corrosion Science, 210, 110833, Article ID 110833.
Open this publication in new window or tab >>Penetration of corrosive species into copper exposed to simulated O2-free groundwater by time-of-flight secondary ion mass spectrometry (ToF-SIMS)
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2023 (English)In: Corrosion Science, ISSN 0010-938X, E-ISSN 1879-0496, Vol. 210, p. 110833-, article id 110833Article in journal (Refereed) Published
Abstract [en]

ToF-SIMS analysis of copper samples after exposures to simulated groundwater with and without sulfide addition was performed to investigate the penetration of corrosive species containing H, S, O, and Cl, into copper. Depth profiles show extent of penetration and 2D/3D images reveal local elemental distribution of the corrosive species at different depths inside copper. Pre-oxidation did not reduce the penetration while sulfide additional in groundwater and exposure at 60 degrees C significantly promoted the penetration. The extent of penetration of the corrosive species into copper demonstrates the need for risk assessment of complex corrosion forms such as sulfide-induced embrittlement and cracking.

Place, publisher, year, edition, pages
Elsevier BV, 2023
Keywords
Copper, Anoxic corrosion, Sulfide, ToF-SIMS, Nuclear waste
National Category
Metallurgy and Metallic Materials
Identifiers
urn:nbn:se:kth:diva-323036 (URN)10.1016/j.corsci.2022.110833 (DOI)000903715600001 ()2-s2.0-85143213802 (Scopus ID)
Note

QC 20230112

Available from: 2023-01-12 Created: 2023-01-12 Last updated: 2024-05-02Bibliographically approved
Pan, J., Yue, X., Malmberg, P., Isotahdon, E., Ratia-Hanby, V., Huttunen-Saarivirta, E. & Leygraf, C. (2023). Reply to comment on "Penetration of corrosive species into copper exposed to simulated O2-free groundwater by time-of-flight secondary ion mass spectrometry (ToF-SIMS)" [Letter to the editor]. Corrosion Science, 217, Article ID 111137.
Open this publication in new window or tab >>Reply to comment on "Penetration of corrosive species into copper exposed to simulated O2-free groundwater by time-of-flight secondary ion mass spectrometry (ToF-SIMS)"
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2023 (English)In: Corrosion Science, ISSN 0010-938X, E-ISSN 1879-0496, Vol. 217, article id 111137Article in journal, Letter (Refereed) Published
Place, publisher, year, edition, pages
Elsevier BV, 2023
Keywords
Copper, Nuclear waste disposal, Sulphur-induced corrosion, Hydrogen embrittlement, ToF-SIMS, Nano-SIMS
National Category
Analytical Chemistry
Identifiers
urn:nbn:se:kth:diva-326872 (URN)10.1016/j.corsci.2023.111137 (DOI)000975166200001 ()2-s2.0-85151452206 (Scopus ID)
Note

QC 20230515

Available from: 2023-05-15 Created: 2023-05-15 Last updated: 2024-05-02Bibliographically approved
Zhang, H., Leygraf, C., Wen, L., Huang, F., Chang, H. & Jin, Y. (2023). The formation of hydride and its influence on Ti-6Al-4V alloy fracture behavior. International journal of hydrogen energy, 48(92), 36169-36184
Open this publication in new window or tab >>The formation of hydride and its influence on Ti-6Al-4V alloy fracture behavior
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2023 (English)In: International journal of hydrogen energy, ISSN 0360-3199, E-ISSN 1879-3487, Vol. 48, no 92, p. 36169-36184Article in journal (Refereed) Published
Abstract [en]

The fracture mechanism of hydrogen charged Ti-6Al-4V has been investigated through a multianalytical approach. The difference in hydrogen solubility between 13 phase (high solubility) anda phase (low) governs the formation and growth pattern of titanium hydrides, and determine the fracture mode of Ti-6Al-4V. Depending on the hydrogen charging extent, the penetration of hydrogen and distribution of hydrides can be divided into three stages. In the initial stage hydrogen diffuses mainly into the 13 phase, as judged from its increase in Volta potential, and with no hydrides formed. Failure analysis after tensile tests exhibits plastic behavior and a fracture surface with mainly dimples. In the subsequent transition stage, hydrides are formed at the a/13 interfaces and along a grain boundaries. More initial cracks occur in the brittle hydrides and the fracture surface transforms from dimple to quasi-cleavage. In the final stage a layer of uniformly distributed hydride is produced on the surface and within the a phase. Supported by nanoindentation measurements, the plasticity of the charged sample diminishes with hydrogen charging time, and an intergranular-transgranular mixed fracture is observed. Overall, the study forms clear evidence that the distribution and cracks of hydrides influence the fracture mode of the Ti-6A-4V alloy.

Place, publisher, year, edition, pages
Elsevier BV, 2023
Keywords
Titanium alloy, Hydrogen embrittlement, Hydride, Nanoindentation, Scanning Kelvin probe force microscopy
National Category
Other Materials Engineering
Identifiers
urn:nbn:se:kth:diva-340888 (URN)10.1016/j.ijhydene.2023.05.226 (DOI)001106923100001 ()2-s2.0-85162890894 (Scopus ID)
Note

QC 20231215

Available from: 2023-12-15 Created: 2023-12-15 Last updated: 2023-12-15Bibliographically approved
Bender, R., Féron, D., Mills, D., Ritter, S., Bäßler, R., Bettge, D., . . . Zheludkevich, M. (2022). Corrosion challenges towards a sustainable society. Materials and corrosion - Werkstoffe und Korrosion, 73(11), 1730-1751
Open this publication in new window or tab >>Corrosion challenges towards a sustainable society
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2022 (English)In: Materials and corrosion - Werkstoffe und Korrosion, ISSN 0947-5117, E-ISSN 1521-4176, Vol. 73, no 11, p. 1730-1751Article in journal (Refereed) Published
Abstract [en]

A global transition towards more sustainable, affordable and reliable energy systems is being stimulated by the Paris Agreement and the United Nation's 2030 Agenda for Sustainable Development. This poses a challenge for the corrosion industry, as building climate-resilient energy systems and infrastructures brings with it a long-term direction, so as a result the long-term behaviour of structural materials (mainly metals and alloys) becomes a major prospect. With this in mind “Corrosion Challenges Towards a Sustainable Society” presents a series of cases showing the importance of corrosion protection of metals and alloys in the development of energy production to further understand the science of corrosion, and bring the need for research and the consequences of corrosion into public and political focus. This includes emphasis on the limitation of greenhouse gas emissions, on the lifetime of infrastructures, implants, cultural heritage artefacts, and a variety of other topics. 

Place, publisher, year, edition, pages
Wiley, 2022
Keywords
corrosion, corrosion costs, corrosion protection, preventive strategies, Corrosion prevention, Gas emissions, Greenhouse gases, Sustainable development, Energy infrastructures, Energy systems, Global transitions, Metals and alloys, Reliable energy, Sustainable energy, Sustainable society, United Nations
National Category
Surface- and Corrosion Engineering
Identifiers
urn:nbn:se:kth:diva-325265 (URN)10.1002/maco.202213140 (DOI)000821629400001 ()2-s2.0-85133500656 (Scopus ID)
Note

QC 20230404

Available from: 2023-04-04 Created: 2023-04-04 Last updated: 2025-02-09Bibliographically approved
Zhao, W., Babu, P., Chang, T., Odnevall Wallinder, I., Hedström, P., Johnson, C. M. & Leygraf, C. (2022). Initial atmospheric corrosion studies of copper from macroscale to nanoscale in a simulated indoor atmospheric environment. Corrosion Science, 195, Article ID 109995.
Open this publication in new window or tab >>Initial atmospheric corrosion studies of copper from macroscale to nanoscale in a simulated indoor atmospheric environment
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2022 (English)In: Corrosion Science, ISSN 0010-938X, E-ISSN 1879-0496, Vol. 195, article id 109995Article in journal (Refereed) Published
Abstract [en]

Corrosion effects on copper exposed in a humid atmosphere with formic acid (mimicking indoor corrosion) have been explored through successive increase in surface lateral resolution from macroscale (IRRAS, GIXRD) over microscale (LOM, SEM, IR microscopy) to nanoscale (Nano-FTIR, FIB/SEM/EDS). Initial more uniform growth of Cu2O is followed by more varying topography and thickness until local removal of Cu2O enables the aqueous adlayer to react with the copper substrate. Local formation of Cu(OH)(HCOO) and adjacent Cu2O provide microscopic and spectroscopic evidence of corrosion cells. Nano-FTIR shows that the density of Cu(OH)(HCOO) nuclei, but not their size, increases with exposure time.

Place, publisher, year, edition, pages
Elsevier BV, 2022
Keywords
Copper, Atmospheric corrosion, Nano-FTIR, SEM, FIB, EDS, Corrosion cell
National Category
Surface- and Corrosion Engineering
Identifiers
urn:nbn:se:kth:diva-311883 (URN)10.1016/j.corsci.2021.109995 (DOI)000783072900002 ()2-s2.0-85120685093 (Scopus ID)
Note

QC 20220506

Available from: 2022-05-06 Created: 2022-05-06 Last updated: 2025-02-09Bibliographically approved
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ORCID iD: ORCID iD iconorcid.org/0000-0002-9453-1333

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