N. Daghbouj , H.S. Sen , M. Bensalem , J. Duchoň , B. Li , M. Karlík , F. Ge , V. Krsjak , P. Bábor , M.O. Liedke , M. Butterling , A. Wagner , B. Karasulu , T. Polcar
{"title":"HCP/BCC Zr/Nb多层界面的不对称缺陷吸收行为:Nb层的气泡剥蚀区","authors":"N. Daghbouj , H.S. Sen , M. Bensalem , J. Duchoň , B. Li , M. Karlík , F. Ge , V. Krsjak , P. Bábor , M.O. Liedke , M. Butterling , A. Wagner , B. Karasulu , T. Polcar","doi":"10.1016/j.actamat.2025.121579","DOIUrl":null,"url":null,"abstract":"<div><div>Radiation-induced helium (He) bubble formation poses a major challenge to the structural integrity of materials in nuclear energy systems. In this study, we investigate defect evolution and He behavior in Zr/Nb nanoscale metallic multilayers (NMMs) with immiscible BCC/HCP interfaces, irradiated with 80 keV He ions at fluences ranging from 1 × 10¹⁶ to 1 × 10¹⁷ He/cm². For comparison, single-crystal Nb and polycrystalline Zr were also irradiated under identical conditions to serve as reference materials. Using cross-sectional TEM, SIMS, STEM-EELS, nanoindentation, Doppler Broadening Positron Annihilation Spectroscopy (DBPAS), Positron Annihilation Lifetime Spectroscopy (PALS), and atomistic simulations (DFT and MD), we reveal a highly asymmetric damage response across the multilayer interfaces. Zr layers exhibit larger He bubbles (1.5–2.8 nm), higher swelling (∼1.2%), and greater helium retention, while Nb layers develop bubble-denuded zones (BDZs) exclusively around the interfaces, where bubble nucleation is strongly suppressed and swelling is limited to ∼0.4%. This asymmetry arises from differences in atomic transport properties: DFT calculations show lower migration barriers for vacancies and He atoms in Nb (0.4 and 0.19 eV, respectively), enabling efficient defect migration and recombination at interfaces, whereas Zr retains defects due to higher migration barriers. EELS and DBS-PALS measurements confirm bubble densities of 63–96 He/nm³ and the presence of sub-nanometer open volumes. Compared to monolithic samples, the Zr/Nb multilayers exhibit ∼50% lower irradiation-induced hardening and reduced He retention (11% vs. 17.5% in single-crystal Nb and 16% in polycrystalline Zr). These findings highlight the role of interfaces in driving asymmetric radiation damage and demonstrate the effectiveness of BCC Nb layers in mitigating defect growth. Overall, Zr/Nb multilayers are established as a superior alternative to conventional single- and polycrystalline materials for extreme irradiation environments.</div></div>","PeriodicalId":238,"journal":{"name":"Acta Materialia","volume":"301 ","pages":"Article 121579"},"PeriodicalIF":9.3000,"publicationDate":"2025-09-24","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Asymmetrical defect sink behavior of HCP/BCC Zr/Nb multilayer interfaces: Bubble-denuded zones at Nb layers\",\"authors\":\"N. Daghbouj , H.S. Sen , M. Bensalem , J. Duchoň , B. Li , M. Karlík , F. Ge , V. Krsjak , P. Bábor , M.O. Liedke , M. Butterling , A. Wagner , B. Karasulu , T. Polcar\",\"doi\":\"10.1016/j.actamat.2025.121579\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><div>Radiation-induced helium (He) bubble formation poses a major challenge to the structural integrity of materials in nuclear energy systems. In this study, we investigate defect evolution and He behavior in Zr/Nb nanoscale metallic multilayers (NMMs) with immiscible BCC/HCP interfaces, irradiated with 80 keV He ions at fluences ranging from 1 × 10¹⁶ to 1 × 10¹⁷ He/cm². For comparison, single-crystal Nb and polycrystalline Zr were also irradiated under identical conditions to serve as reference materials. Using cross-sectional TEM, SIMS, STEM-EELS, nanoindentation, Doppler Broadening Positron Annihilation Spectroscopy (DBPAS), Positron Annihilation Lifetime Spectroscopy (PALS), and atomistic simulations (DFT and MD), we reveal a highly asymmetric damage response across the multilayer interfaces. Zr layers exhibit larger He bubbles (1.5–2.8 nm), higher swelling (∼1.2%), and greater helium retention, while Nb layers develop bubble-denuded zones (BDZs) exclusively around the interfaces, where bubble nucleation is strongly suppressed and swelling is limited to ∼0.4%. This asymmetry arises from differences in atomic transport properties: DFT calculations show lower migration barriers for vacancies and He atoms in Nb (0.4 and 0.19 eV, respectively), enabling efficient defect migration and recombination at interfaces, whereas Zr retains defects due to higher migration barriers. EELS and DBS-PALS measurements confirm bubble densities of 63–96 He/nm³ and the presence of sub-nanometer open volumes. Compared to monolithic samples, the Zr/Nb multilayers exhibit ∼50% lower irradiation-induced hardening and reduced He retention (11% vs. 17.5% in single-crystal Nb and 16% in polycrystalline Zr). These findings highlight the role of interfaces in driving asymmetric radiation damage and demonstrate the effectiveness of BCC Nb layers in mitigating defect growth. Overall, Zr/Nb multilayers are established as a superior alternative to conventional single- and polycrystalline materials for extreme irradiation environments.</div></div>\",\"PeriodicalId\":238,\"journal\":{\"name\":\"Acta Materialia\",\"volume\":\"301 \",\"pages\":\"Article 121579\"},\"PeriodicalIF\":9.3000,\"publicationDate\":\"2025-09-24\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Acta Materialia\",\"FirstCategoryId\":\"88\",\"ListUrlMain\":\"https://www.sciencedirect.com/science/article/pii/S1359645425008651\",\"RegionNum\":1,\"RegionCategory\":\"材料科学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q1\",\"JCRName\":\"MATERIALS SCIENCE, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Acta Materialia","FirstCategoryId":"88","ListUrlMain":"https://www.sciencedirect.com/science/article/pii/S1359645425008651","RegionNum":1,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q1","JCRName":"MATERIALS SCIENCE, MULTIDISCIPLINARY","Score":null,"Total":0}
Asymmetrical defect sink behavior of HCP/BCC Zr/Nb multilayer interfaces: Bubble-denuded zones at Nb layers
Radiation-induced helium (He) bubble formation poses a major challenge to the structural integrity of materials in nuclear energy systems. In this study, we investigate defect evolution and He behavior in Zr/Nb nanoscale metallic multilayers (NMMs) with immiscible BCC/HCP interfaces, irradiated with 80 keV He ions at fluences ranging from 1 × 10¹⁶ to 1 × 10¹⁷ He/cm². For comparison, single-crystal Nb and polycrystalline Zr were also irradiated under identical conditions to serve as reference materials. Using cross-sectional TEM, SIMS, STEM-EELS, nanoindentation, Doppler Broadening Positron Annihilation Spectroscopy (DBPAS), Positron Annihilation Lifetime Spectroscopy (PALS), and atomistic simulations (DFT and MD), we reveal a highly asymmetric damage response across the multilayer interfaces. Zr layers exhibit larger He bubbles (1.5–2.8 nm), higher swelling (∼1.2%), and greater helium retention, while Nb layers develop bubble-denuded zones (BDZs) exclusively around the interfaces, where bubble nucleation is strongly suppressed and swelling is limited to ∼0.4%. This asymmetry arises from differences in atomic transport properties: DFT calculations show lower migration barriers for vacancies and He atoms in Nb (0.4 and 0.19 eV, respectively), enabling efficient defect migration and recombination at interfaces, whereas Zr retains defects due to higher migration barriers. EELS and DBS-PALS measurements confirm bubble densities of 63–96 He/nm³ and the presence of sub-nanometer open volumes. Compared to monolithic samples, the Zr/Nb multilayers exhibit ∼50% lower irradiation-induced hardening and reduced He retention (11% vs. 17.5% in single-crystal Nb and 16% in polycrystalline Zr). These findings highlight the role of interfaces in driving asymmetric radiation damage and demonstrate the effectiveness of BCC Nb layers in mitigating defect growth. Overall, Zr/Nb multilayers are established as a superior alternative to conventional single- and polycrystalline materials for extreme irradiation environments.
期刊介绍:
Acta Materialia serves as a platform for publishing full-length, original papers and commissioned overviews that contribute to a profound understanding of the correlation between the processing, structure, and properties of inorganic materials. The journal seeks papers with high impact potential or those that significantly propel the field forward. The scope includes the atomic and molecular arrangements, chemical and electronic structures, and microstructure of materials, focusing on their mechanical or functional behavior across all length scales, including nanostructures.