Computational Screening of Metal–Organic Framework-Supported Single-Atom Transition-Metal Catalysts for the Gas-Phase Hydrolysis of Nerve Agents

ACS Catalysis ◽  
2019 ◽  
Vol 10 (2) ◽  
pp. 1310-1323 ◽  
Author(s):  
Matthew L. Mendonca ◽  
Randall Q. Snurr
Keyword(s):  
Transition Metal ◽  
Gas Phase ◽  
Metal Organic Framework ◽  
Nerve Agents ◽  
Metal Catalysts ◽  
Transition Metal Catalysts ◽  
Single Atom ◽  
Computational Screening ◽  
Metal Organic ◽  
Hydrolysis Of

scholarly journals The effects of active site and support on hydrogen elimination over transition-metal-functionalized yttria-decorated metal–organic frameworks

2019 ◽  
Vol 9 (24) ◽  
pp. 7003-7015
Author(s):  
Bo Yang ◽  
Kamal Sharkas ◽  
Laura Gagliardi ◽  
Donald G. Truhlar
Keyword(s):  
Transition Metal ◽  
Active Site ◽  
Metal Organic Framework ◽  
Metal Organic Frameworks ◽  
Metal Catalysts ◽  
Transition Metal Catalysts ◽  
Hydrogen Elimination ◽  
Metal Organic ◽  
Catalytic Cycles ◽  
Organic Framework

Transition-metal catalysts supported on a metal–organic framework have been screened computationally to reveal the best catalytic candidates for hydrogen elimination reactions, which are critical in many catalytic cycles.

scholarly journals Graphene Supported Single Atom Transition Metal Catalysts for Methane Activation

ChemCatChem ◽  
2018 ◽  
Vol 10 (15) ◽  
pp. 3229-3235 ◽  
Author(s):  
Sanjubala Sahoo ◽  
Steven L. Suib ◽  
S. Pamir Alpay
Keyword(s):  
Transition Metal ◽  
Metal Catalysts ◽  
Transition Metal Catalysts ◽  
Methane Activation ◽  
Single Atom

Gas-Phase Polymerization with Transition Metal Catalysts Supported on Montmorillonite - A Particle Morphological Study

2009 ◽  
Vol 285 (1) ◽  
pp. 64-73 ◽  
Author(s):  
Sang-Young A. Shin ◽  
Leonardo C. Simon ◽  
João B. P. Soares ◽  
Günter Scholz ◽  
Timothy F. L. McKenna
Keyword(s):  
Transition Metal ◽  
Gas Phase ◽  
Morphological Study ◽  
Metal Catalysts ◽  
Transition Metal Catalysts ◽  
Gas Phase Polymerization
Sign in / Sign up

Export Citation Format

Share Document