Si-Doped Fe Catalyst for Ammonia Synthesis at Dramatically Decreased Pressures and Temperatures حسب Qi An (331241)

"…Surprisingly, we found a very promising subsurface dopant, Si, that had not been identified or suggested previously, showing the importance of the subsurface Fe atoms in N₂ reduction reactions. Then we derived the full reaction path of the HB process for the Si doped Fe-bcc(111) from QM simulations, which we combined with kinetic Monte Carlo (kMC) simulations to predict a ∼13-fold increase in turnover frequency (TOF) under typical extreme HB conditions (200 atm reactant pressure and 500 °C) and a ∼43-fold increase in TOF under ideal HB conditions (20 atm reactant pressure and 400 °C) for the Si-doped Fe catalyst, in comparison to pure Fe catalyst. …"

Si-Doped Fe Catalyst for Ammonia Synthesis at Dramatically Decreased Pressures and Temperatures حسب Qi An (331241)

"…Surprisingly, we found a very promising subsurface dopant, Si, that had not been identified or suggested previously, showing the importance of the subsurface Fe atoms in N₂ reduction reactions. Then we derived the full reaction path of the HB process for the Si doped Fe-bcc(111) from QM simulations, which we combined with kinetic Monte Carlo (kMC) simulations to predict a ∼13-fold increase in turnover frequency (TOF) under typical extreme HB conditions (200 atm reactant pressure and 500 °C) and a ∼43-fold increase in TOF under ideal HB conditions (20 atm reactant pressure and 400 °C) for the Si-doped Fe catalyst, in comparison to pure Fe catalyst. …"

Electrochemical Reduction of N₂O with a Molecular Copper Catalyst حسب Jorge L. Martinez (4471651)

"…Natural N₂O reduction occurs via a Cu cofactor, but there is a notable dearth of synthetic molecular Cu catalysts for this process. …"

Electrochemical Reduction of N₂O with a Molecular Copper Catalyst حسب Jorge L. Martinez (4471651)

"…Natural N₂O reduction occurs via a Cu cofactor, but there is a notable dearth of synthetic molecular Cu catalysts for this process. …"

Electrochemical Reduction of N₂O with a Molecular Copper Catalyst حسب Jorge L. Martinez (4471651)

"…Natural N₂O reduction occurs via a Cu cofactor, but there is a notable dearth of synthetic molecular Cu catalysts for this process. …"

Kirigami Photopiezo Catalysts for Self-Sustainable Environment Remediation حسب Won Jin Choi (1649125)

الموضوعات:

Kirigami Photopiezo Catalysts for Self-Sustainable Environment Remediation حسب Won Jin Choi (1649125)

الموضوعات:

Kirigami Photopiezo Catalysts for Self-Sustainable Environment Remediation حسب Won Jin Choi (1649125)

الموضوعات:

Kirigami Photopiezo Catalysts for Self-Sustainable Environment Remediation حسب Won Jin Choi (1649125)

الموضوعات:

Kirigami Photopiezo Catalysts for Self-Sustainable Environment Remediation حسب Won Jin Choi (1649125)

الموضوعات:

Kirigami Photopiezo Catalysts for Self-Sustainable Environment Remediation حسب Won Jin Choi (1649125)

الموضوعات:

Atomistic Insights into the Degradation of Metal Phthalocyanine Catalysts during Oxygen Reduction Reaction حسب Huanhuan Yang (4616335)

"…Oxygen reduction catalysts frequently suffer from degradation under harsh operating conditions, and a limited understanding of the underlying mechanisms hampers the development of effective mitigation strategies. …"

Key Role of Density Functional Approximation in Predicting M–N–C Catalyst Activities for Oxygen Reduction حسب Brett Henderson (12975197)

الموضوعات:

Alkali Metal Cations Induce Pseudo-outer-sphere Oxygen Reduction Reaction Mechanism in Electrolyte-Catalyst Synergy حسب Yumiao Tian (17188309)

الموضوعات:

Alkali Metal Cations Induce Pseudo-outer-sphere Oxygen Reduction Reaction Mechanism in Electrolyte-Catalyst Synergy حسب Yumiao Tian (17188309)

الموضوعات:

Alkali Metal Cations Induce Pseudo-outer-sphere Oxygen Reduction Reaction Mechanism in Electrolyte-Catalyst Synergy حسب Yumiao Tian (17188309)

الموضوعات:

Alkali Metal Cations Induce Pseudo-outer-sphere Oxygen Reduction Reaction Mechanism in Electrolyte-Catalyst Synergy حسب Yumiao Tian (17188309)

الموضوعات:

(a) X-ray diffraction (XRD) pattern of the cobalt nitrate catalyst, showing the crystallinity and phase structure of the Co/Al₂O₃ catalyst. (b) Fourier transform infrared (FTIR) sp... حسب Ning Zuo (17295415)

الموضوعات:

Dynamic Evolution from Single-Atom Catalysts to Active Nanograins for CO₂ Reduction حسب Juhyung Choi (11809596)

In Situ X‑Ray Absorption Spectroscopy Disentangles the Roles of Copper and Silver in a Bimetallic Catalyst for the Oxygen Reduction Reaction حسب Brenna M. Gibbons (8500887)

"…Silver-based bimetallic catalysts for the oxygen reduction reaction (ORR) are promising for a wide variety of renewable energy technologies, including alkaline fuel cells and metal-air batteries. …"