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Different transition metals are employed to tune the Y-doped BaZrO 3 proton conductor, resulting in the new BaZr 0.125 Y 0.125 M 0.75 O 3 (M = Cu, Mn, Ni, Zn, Co, and Fe) compositions as cathodes for proton-conducting solid oxide fuel cells. Only Co and Fe dopants can yield pure phases, whereas the use of other dopants results in impurities. Further experimental studies and first-principles calculations show that using Fe dopant has some advantages over Co-doped material, such as increased oxygen vacancies, lower proton migration energy barriers, and faster proton and oxygen diffusion kinetics. The fuel cell employing the BaZr 0.125 Y 0.125 Fe 0.75 O 3 (BZYFe) cathode has a larger fuel cell output than the fuel cell using the BaZr 0.125 Y 0.125 Co 0.75 O 3 (BZYCo) cathode. Furthermore, the CO 2 adsorption energy on the BZYFe surface is larger than that at the BZYCo surface, indicating that BZYFe has significantly better chemical stability than BZYCo. The long-term stability of the fuel cell demonstrates that the fuel cell with the BZYCo cathode is degrading. In contrast, the BZYFe cell has good operating stability. Given its phase purity, fuel cell performance, and stability, the Fe element is an appropriate dopant for altering BZY and creating a new cathode. • BaZr 0.125 Y 0.125 M 0.75 O 3 (M = Cu, Mn, Ni, Zn, Co, and Fe) were prepared. • Only Co and Fe dopants can generate pure phases. • BaZr 0.125 Y 0.125 Co 0.75 O 3 and BaZr 0.125 Y 0.125 Fe 0.75 O 3 cathodes yielded similar cell performance. • The cell using BaZr 0.125 Y 0.125 Fe 0.75 O 3 cathode showed better operational stability. [ABSTRACT FROM AUTHOR]

This study proposes a new Pr 0.25 Nd 0.25 Ca 0.5 MnO 3-δ (PNCM) cathode material for protonic ceramic fuel cells (PCFCs). As demonstrated by first-principles calculations, the Ca-doping strategy can promote oxygen vacancy formation and accelerate the oxygen reduction reaction (ORR) compared to the conventional Sr-doping method. Additional experiments reveal the doping of Ca can enhance the proton and oxygen diffusion abilities compared with the traditional Sr-doped material. Consequently, the PCFC with single-phase PNCM cathode produces a high peak power density of 1232 mW cm-2 at 700 °C, which is significantly greater than the cell with Sr-doped cathode, which only produces 749 mW cm-2 under the same testing conditions. The PNCM cathode inherits the excellent stability of manganate cathodes, allowing the fuel cell to exhibit good stability under operational conditions. PNCM is a new and promising cathode material for PCFCs due to its excellent fuel cell performance and stability. [ABSTRACT FROM AUTHOR]

Sintering aids are commonly used to improve the sinterability of proton-conducting oxides, whereas the sintering aid elements are being used alone in previous research. In this study, a high-entropy design method for the BaCe 0.4 Zr 0.4 Y 0.2 O 3 (BCZY) proton-conducting oxides sintering aid is proposed. In contrast to the use of sintering aids such as Ni, Fe, Cu, Co, and Zn alone, the high-entropy design allows for the simultaneous use of all five elements, resulting in the new composition BaCe 0.4 Zr 0.4 Y 0.15 Ni 0.01 Cu 0.01 Co 0.01 Fe 0.01 Zn 0.01 O 3 (HE-BCZY). Compared to conventional BaCe 0.4 Zr 0.4 Y 0.15 M 0.05 O 3 (BCZYM, M = Ni, Cu, Co, Fe, Zn) materials, the sinterability of the new HE-BCZY material is significantly greater than that of BCZYM, despite the fact that the concentration of sintering aids is the same. Following sintering at 1300 °C, the HE-BCZY electrolyte membrane is completely dense. In addition, the HE-BCZY electrolyte has a higher conductivity than BCZYM. The low sintering temperature allows the successful preparation of proton ceramic fuel cells (PCFCs) with the HE-BCZY electrolyte, and the fuel cell reaches a high peak power density of 1218 mW cm−2 at 700 °C, which is much higher than that of PCFCs using BCZY-based electrolytes. In addition, the excellent chemical stability of HE-BCZY is maintained under both H 2 O and CO 2 conditions. Consequently, a fuel cell employing the HE-BCZY electrolyte operates without detectable degradation for 200 h. This study demonstrates that although the high-entropy design is seldom used for sintering aids of proton-conducting oxides, it is an intriguing and promising strategy for creating high-performance electrolyte materials with good sinterability, high conductivity, and excellent stability. [ABSTRACT FROM AUTHOR]

Transition metal elements were employed to customize the standard Sr 2 Fe 1.5 Mo 0.5 O 6 (SFM) material, with the goal of improving the performance of the SFM cathode in proton-conducting solid oxide fuel cells (H–SOFCs). Sr 2 FeMo 0.5 X 0.5 O 6 (X = Ni, Co, Mn, Zn) materials were prepared, but it was discovered that only the dopants Ni and Co can form a pure phase, whereas the dopants Mn and Zn produced an obvious secondary phase. When comparing oxygen vacancies and oxygen diffusion kinetics, utilizing the Co-dopant exhibited clear advantages. The Co-doped SFM had a higher oxygen vacancy content and faster oxygen diffusion kinetics than both the standard and Ni-doped SFM cathodes. The energy barrier for the oxygen reduction reaction (ORR) at the Co-doped SFM cathode was 0.76 eV, which was much lower than that for the SFM and Ni-doped SFM, which were 5.52 and 2.28 eV, respectively. As a result, the Co-doped SFM's cathode reaction was greatly accelerated, resulting in a high fuel cell performance of 1306 mW cm−2 at 700 °C. This finding suggests that using the appropriate dopant can alleviate the low-performance problem of the traditional SFM cathode, resulting in a promising cathode option for H–SOFCs. • Sr 2 FeMo 0.5 X 0.5 O 6 (X = Ni, Co, Mn, Zn) cathodes were proposed for H–SOFCs. • The Co dopant showed more advantages compared with other dopants. • The Sr 2 FeMo 0.5 Co 0.5 O 6 cathode delivered high fuel cell performance. • The mechanism for the enhanced cathode performance was revealed. [ABSTRACT FROM AUTHOR]

LaNi 0.5 Fe 0.5 O 3-δ (LNF) is a viable option for the cathode of solid oxide fuel cells (SOFCs), however, its performance in proton-conducting SOFCs (H–SOFCs) is not sufficient. In this work, an Sc-doped method to increase the cathode performance of conventional LNF for H–SOFCs is proposed. Although the Sc cation can be doped at the Ni site or the Fe site in LNF, which led to the formation of pure phase materials, first-principles calculations indicate that the formation of the LaNi 0.4 Sc 0.1 Fe 0.5 O 3-δ (LNSF) material has more advantages than the formation of the LaNi 0.5 Fe 0.4 Sc 0.1 O 3-δ (LNFS) material, even though the same Sc-doping level is employed. Compared to Sc-free LNF, LNSF provides superior fuel cell performance. At 700 °C, the LNSF cell generates a peak power density of 1534 mW cm−2, double that of the LNF cell. In addition, employing the LNSF cathode reduces the cell's polarization resistance, indicating that the Sc-doping strategy paired with selecting the doping site is an effective method for reusing LNF in high-performance H–SOFCs. • Sc cations can be doped at the Fe or Ni sites in LaNi 0.5 Fe 0.5 O 3-δ (LNF). • The site occupation at the Ni site shows advantages compared with that at the Fe site. • Sc-doped LNF shows better performance than the Sc-free one. • The performance of the cell using LaNi 0.4 Sc 0.1 Fe 0.5 O 3-δ is better. [ABSTRACT FROM AUTHOR]

As a cathode material for proton-conducting SOFCs (H–SOFCs), a novel MnCo 1.9 Sb 0.1 O 4 (MCSO) spinel material was suggested. The MCSO material was effectively produced, and it demonstrated excellent phase stability at elevated temperatures and chemical stability against CO 2 and H 2 O. Doping Sb into the MnCo 2 O 4 (MCO) allowed for enhanced proton diffusion and surface exchange, as evidenced by electrical conductivity relaxation tests. In addition, an oxygen-vacancy-rich surface was developed for the MCSO material, resulting in the possibility of a high cathode oxygen reduction reaction activity. The MCSO material was examined in the H–SOFC application, and the fuel cell with an MCSO cathode attained a high power density of 1380 mW cm−2 at 700 °C. At 700 °C, the cell employing the Sb-free MCO cathode, which had a comparable cell microstructure to the MCSO cell, only obtained a peak power density of 836 mW cm−2. The higher cell performance resulted from the Sb-modified MCO cathode's increased catalytic activity. In addition, the MCSO cell displayed excellent operational stability under fuel cell operating conditions, indicating that MCSO is a novel and effective spinel cathode for H–SOFCs. • A new MnCo 1.9 Sb 0.1 O 4 (MCSO) spinel was proposed for H–SOFCs. • Doping Sb into MnCo 2 O 4 (MCO) enhanced proton diffusion and surface exchange. • MCSO improved the cathode activity compared with Sb-free MCO. • A high performance was obtained for the fuel cell using MCSO cathode. [ABSTRACT FROM AUTHOR]

[Display omitted] • The new Pr 0.5 Sr 0.5 Fe 0.9 Mn 0.1 O 3 cathode was prepared. • The Mn-doping method mitigated the high thermal expansion of Pr 0.5 Sr 0.5 FeO 3. • The oxygen vacancy formation and proton diffusion were improved with Mn-doping. • Better fuel cell performance was obtained with the cathode using Mn-doping. The traditional Pr 0.5 Sr 0.5 FeO 3 (PSF) cathode is customized with Mn cations to generate the new Pr 0.5 Sr 0.5 Fe 0.9 Mn 0.1 O 3 (PSFMn) cathode for proton-conducting solid oxide fuel cells (H-SOFCs). Compared to the PSF oxide, the new PSFMn has a reduced thermal expansion, making it more compatible with electrolytes. Furthermore, Mn-doping enhances oxygen vacancy production in PSF, as revealed by experimental and first-principle calculations. More crucially, doping Mn into PSF improves proton diffusion kinetics, resulting in quicker proton diffusion and surface exchange. As a result, the H-SOFC with the PSFMn cathode achieves an output of 1446 mW cm−2 at 700 °C, but the PSF cell only achieves fuel cell performance of 1009 mW cm−2. The fundamental cause of the increased cell performance is the significantly reduced polarization resistance, implying that using the Mn-doping strategy enhances the cathode kinetics of conventional PSF cathodes for H-SOFC. [ABSTRACT FROM AUTHOR]