Rational Design of Main Group Metal-Embedded Nitrogen-Doped Carbon Materials as Frustrated Lewis Pair Catalysts for CO2 Hydrogenation to Formic Acid

2021 ◽  
Author(s):  
Yue Zhang ◽  
Yirong Mo ◽  
Zexing Cao
Keyword(s):  
Formic Acid ◽  
Rational Design ◽  
Carbon Materials ◽  
Main Group ◽  
Co2 Hydrogenation ◽  
Nitrogen Doped ◽  
Group Metal ◽  
Frustrated Lewis Pair ◽  
Main Group Metal ◽  
Nitrogen Doped Carbon

scholarly journals Metal‐Nitrogen‐Doped Carbon Materials as Highly Efficient Catalysts: Progress and Rational Design

2020 ◽  
Vol 7 (15) ◽  
pp. 2001069 ◽  
Author(s):  
Zhangsheng Shi ◽  
Wenqing Yang ◽  
Yuantong Gu ◽  
Ting Liao ◽  
Ziqi Sun
Keyword(s):  
Rational Design ◽  
Carbon Materials ◽  
Nitrogen Doped ◽  
Highly Efficient ◽  
Nitrogen Doped Carbon

Reversible Addition of Carbon Dioxide to Main Group Metal Complexes at Temperatures about 0 °C

2021 ◽  
Author(s):  
Tatyana S. Koptseva ◽  
Vladimir G. Sokolov ◽  
Sergey Yu. Ketkov ◽  
Elena A. Rychagova ◽  
Anton V. Cherkasov ◽  
...  
Keyword(s):  
Carbon Dioxide ◽  
Metal Complexes ◽  
Main Group ◽  
Group Metal ◽  
Reversible Addition ◽  
Main Group Metal

scholarly journals Three-dimensional tellurium and nitrogen Co-doped mesoporous carbons for high performance supercapacitors

RSC Advances ◽  
2021 ◽  
Vol 11 (15) ◽  
pp. 8628-8635
Author(s):  
Chang Ki Kim ◽  
Jung-Min Ji ◽  
M. Aftabuzzaman ◽  
Hwan Kyu Kim
Keyword(s):  
High Performance ◽  
Carbon Materials ◽  
Synergetic Effect ◽  
Three Dimensional ◽  
Mesoporous Carbons ◽  
Capacitive Performance ◽  
Nitrogen Doped ◽  
Carbon Based Nanomaterials ◽  
Nitrogen Doped Carbon ◽  
Co Doped

The incorporation of the Te element into nitrogen-doped carbon-based nanomaterials is a good strategy to improve the capacitive performance of carbon materials and the incorporation of two types of atoms improves the overall capacitive performance of the materials due to a synergetic effect.

Effect of delocalization of nonbonding electron density on the stability of the M–Ccarbene bond in main group metal-imidazol-2-ylidene complexes: a computational and structural database study

2021 ◽  
Vol 0 (0) ◽  
Author(s):  
Samuel Tetteh ◽  
Albert Ofori
Keyword(s):  
Electron Density ◽  
Lone Pair ◽  
Main Group ◽  
Binding Energies ◽  
Electrostatic Model ◽  
Group Metal ◽  
Main Group Metal ◽  
Structural Database ◽  
The Stability ◽  
Lone Pair Electrons

Abstract The M–Ccarbene bond in metal (M) complexes involving the imidazol-2-ylidene (Im) ligand has largely been described using the σ-donor only model with donation of σ electrons from the sp-hybridized orbital of the carbene carbon into vacant orbitals on the metal centre. Analyses of the M–Ccarbene bond in a series of group IA, IIA and IIIA main group metal complexes show that the M-Im interactions are mostly electrostatic with the M–Ccarbene bond distances greater than the sum of the respective covalent radii. Estimation of the binding energies of a series of metal hydride/fluoride/chloride imidazol-2-ylidene complexes revealed that the stability of the M–Ccarbene bond in these complexes is not always commensurate with the σ-only electrostatic model. Further natural bond orbital (NBO) analyses at the DFT/B3LYP level of theory revealed substantial covalency in the M–Ccarbene bond with minor delocalization of electron density from the lone pair electrons on the halide ligands into antibonding molecular orbitals on the Im ligand. Calculation of the thermodynamic stability of the M–Ccarbene bond showed that these interactions are mostly endothermic in the gas phase with reduced entropies giving an overall ΔG > 0.

scholarly journals Nitrogen-doped carbon materials with cubic ordered mesostructure: low-temperature autoclaving synthesis for electrochemical supercapacitor and CO2 capture

RSC Advances ◽  
2017 ◽  
Vol 7 (21) ◽  
pp. 12524-12533 ◽  
Author(s):  
Lei Liu ◽  
Shi-Da Xu ◽  
Feng-Yun Wang ◽  
Yue-Jun Song ◽  
Jie Liu ◽  
...  
Keyword(s):  
Low Temperature ◽  
Co2 Capture ◽  
Carbon Materials ◽  
Mesoporous Carbons ◽  
Body Centered Cubic ◽  
Ordered Mesoporous Carbons ◽  
Nitrogen Doped ◽  
Electrochemical Supercapacitor ◽  
Ordered Mesoporous ◽  
Nitrogen Doped Carbon

Nitrogen doped ordered mesoporous carbons with a 3-D body-centered cubic pore structure have been synthesized by means of a low-temperature autoclaving route under basic conditions, showing excellent performances for supercapacitors and CO2 capture.

Main-group metal complexes of α-diimine ligands: structure, bonding and reactivity

2021 ◽  
Author(s):  
Rong Zhang ◽  
Yanchao Wang ◽  
Yanxia Zhao ◽  
Carl Redshaw ◽  
Igor L. Fedushkin ◽  
...  
Keyword(s):  
Metal Complexes ◽  
Small Molecule ◽  
Main Group ◽  
Group Metal ◽  
Diimine Ligands ◽  
Main Group Metal ◽  
Metal Metal ◽  
Low Valent

The use of dad (and bian) ligands in the stabilization of main-group complexes, in particular metal–metal-bonded compounds, as well as the small molecule reactivity of these (low-valent) metal complexes, is summarized.

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