scholarly journals Single‐Atom Electrocatalysts from Multivariate Metal–Organic Frameworks for Highly Selective Reduction of CO 2 at Low Pressures

2020 ◽  
Vol 132 (46) ◽  
pp. 20770-20776 ◽  
Author(s):  
Long Jiao ◽  
Weijie Yang ◽  
Gang Wan ◽  
Rui Zhang ◽  
Xusheng Zheng ◽  
...  
Keyword(s):  
Metal Organic Frameworks ◽  
Selective Reduction ◽  
Single Atom ◽  
Metal Organic ◽  
Low Pressures

scholarly journals Single‐Atom Electrocatalysts from Multivariate Metal–Organic Frameworks for Highly Selective Reduction of CO 2 at Low Pressures

2020 ◽  
Vol 59 (46) ◽  
pp. 20589-20595 ◽  
Author(s):  
Long Jiao ◽  
Weijie Yang ◽  
Gang Wan ◽  
Rui Zhang ◽  
Xusheng Zheng ◽  
...  
Keyword(s):  
Metal Organic Frameworks ◽  
Selective Reduction ◽  
Single Atom ◽  
Metal Organic ◽  
Low Pressures

scholarly journals Modulating electronic structure of metal-organic frameworks by introducing atomically dispersed Ru for efficient hydrogen evolution

2021 ◽  
Vol 12 (1) ◽  
Author(s):  
Yamei Sun ◽  
Ziqian Xue ◽  
Qinglin Liu ◽  
Yaling Jia ◽  
Yinle Li ◽  
...  
Keyword(s):  
Electronic Structure ◽  
Hydrogen Evolution ◽  
Hydrogen Evolution Reaction ◽  
Density Functional ◽  
Metal Organic Frameworks ◽  
Catalyst Design ◽  
Single Atom ◽  
Hydrogen Energy ◽  
Structure Of Metal ◽  
Metal Organic

AbstractDeveloping high-performance electrocatalysts toward hydrogen evolution reaction is important for clean and sustainable hydrogen energy, yet still challenging. Herein, we report a single-atom strategy to construct excellent metal-organic frameworks (MOFs) hydrogen evolution reaction electrocatalyst (NiRu0.13-BDC) by introducing atomically dispersed Ru. Significantly, the obtained NiRu0.13-BDC exhibits outstanding hydrogen evolution activity in all pH, especially with a low overpotential of 36 mV at a current density of 10 mA cm−2 in 1 M phosphate buffered saline solution, which is comparable to commercial Pt/C. X-ray absorption fine structures and the density functional theory calculations reveal that introducing Ru single-atom can modulate electronic structure of metal center in the MOF, leading to the optimization of binding strength for H2O and H*, and the enhancement of HER performance. This work establishes single-atom strategy as an efficient approach to modulate electronic structure of MOFs for catalyst design.

Two-dimensional metal-organic frameworks Mo3(C2O)12 as promising single-atom catalysts for selective nitrogen-to-ammonia

2022 ◽  
Author(s):  
Zhen Feng ◽  
Zelin Yang ◽  
Xiaowen Meng ◽  
Fachuang Li ◽  
Zhanyong Guo ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Density Functional ◽  
Metal Organic Frameworks ◽  
Density Functional Theory Calculations ◽  
Reduction Reaction ◽  
Single Atom ◽  
Two Dimensional ◽  
Functional Theory ◽  
New Family ◽  
Metal Organic

The development of single-atom catalysts (SACs) for electrocatalytic nitrogen reduction reaction (NRR) remains a great challenge. Using density functional theory calculations, we design a new family of two-dimensional metal-organic frameworks...

Effects of Polarizability on the Adsorption of Noble Gases at Low Pressures in Monohalogenated Isoreticular Metal–Organic Frameworks

2012 ◽  
Vol 116 (37) ◽  
pp. 19765-19772 ◽  
Author(s):  
Scott T. Meek ◽  
Stephanie L. Teich-McGoldrick ◽  
John J. Perry ◽  
Jeffery A. Greathouse ◽  
Mark D. Allendorf
Keyword(s):  
Noble Gases ◽  
Metal Organic Frameworks ◽  
Metal Organic ◽  
Low Pressures
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