Large-Scale Free Energy Calculations on a Computational Metal–Organic Frameworks Database: Toward Synthetic Likelihood Predictions

Authors :: Ryther Anderson
Diego A. Gómez-Gualdrón
Source :: Chemistry of Materials. 32:8106-8119
Publication Year :: 2020
Publisher :: American Chemical Society (ACS), 2020.
Abstract: Metal-organic frameworks (MOFs) have captivated the research community due to their modular crystal structure that can be tailored to suit diverse applications. However, identifying ideal MOFs for ...

Subjects :: Ideal (set theory)
business.industry
Computer science
General Chemical Engineering
Scale (chemistry)
02 engineering and technology
General Chemistry
Modular design
010402 general chemistry
021001 nanoscience & nanotechnology
01 natural sciences
0104 chemical sciences
Research community
Materials Chemistry
Metal-organic framework
Biochemical engineering
0210 nano-technology
business
Energy (signal processing)

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