Self-driving laboratories for chemistry and materials science

G Tom, SP Schmid, SG Baird, Y Cao, K Darvish… - Chemical …, 2024 - ACS Publications
Self-driving laboratories (SDLs) promise an accelerated application of the scientific method.
Through the automation of experimental workflows, along with autonomous experimental …

Synthesis of metal-organic frameworks (MOFs): routes to various MOF topologies, morphologies, and composites

N Stock, S Biswas - Chemical reviews, 2012 - ACS Publications
The synthesis of metal-organic frameworks (MOFs) has attracted immense attention during
the last 2 decades due to the possibility to obtain a large variety of aesthetically interesting …

Big-data science in porous materials: materials genomics and machine learning

KM Jablonka, D Ongari, SM Moosavi, B Smit - Chemical reviews, 2020 - ACS Publications
By combining metal nodes with organic linkers we can potentially synthesize millions of
possible metal–organic frameworks (MOFs). The fact that we have so many materials opens …

Efficient removal of greenhouse gases: machine learning-assisted exploration of metal–organic framework space

R **n, C Wang, Y Zhang, R Peng, R Li, J Wang… - ACS …, 2024 - ACS Publications
Global warming is a crisis that humanity must face together. With greenhouse gases (GHGs)
as the main factor causing global warming, the adoption of relevant processes to eliminate …

Computational design and manufacturing of sustainable materials through first-principles and materiomics

SC Shen, E Khare, NA Lee, MK Saad… - Chemical …, 2023 - ACS Publications
Engineered materials are ubiquitous throughout society and are critical to the development
of modern technology, yet many current material systems are inexorably tied to widespread …

New stories of zeolite structures: their descriptions, determinations, predictions, and evaluations

Y Li, J Yu - Chemical reviews, 2014 - ACS Publications
Zeolites are an important class of inorganic crystalline materials that have been widely used
in the fields of petroleum refining, petrochemical industry, and fine chemical industry, as …

Controlling nucleation pathways in zeolite crystallization: seeding conceptual methodologies for advanced materials design

R Jain, AJ Mallette, JD Rimer - Journal of the American Chemical …, 2021 - ACS Publications
A core objective of synthesizing zeolites for widespread applications is to produce materials
with properties and corresponding performances that exceed conventional counterparts …

Quantitative structure–property relationship modeling of diverse materials properties

T Le, VC Epa, FR Burden, DA Winkler - Chemical reviews, 2012 - ACS Publications
The design and synthesis of materials with useful, novel properties is one of the most active
areas of contemporary science, generating a veritable explosion of scientific activity in areas …

Towards the rational design of efficient organic structure‐directing agents for zeolite synthesis

M Moliner, F Rey, A Corma - Angewandte Chemie International …, 2013 - Wiley Online Library
Zeolites are crystalline microporous materials with application in diverse fields, especially in
catalysis. The ability to prepare zeolites with targeted physicochemical properties for a …

Machine learning applied to zeolite synthesis: the missing link for realizing high-throughput discovery

M Moliner, Y Román-Leshkov… - Accounts of chemical …, 2019 - ACS Publications
Conspectus Zeolites are microporous crystalline materials with well-defined cavities and
pores, which can be prepared under different pore topologies and chemical compositions …