High Structural Error Rates in “Computation-Ready” MOF Databases Discovered by Checking Metal Oxidation States
A
Andrew J. White
(Department of Chemistry and Biomolecular Sciences)
M
Marco Gibaldi
(Department of Chemistry and Biomolecular Sciences)
J
Jake Burner
(Department of Chemistry and Biomolecular Sciences)
R
R. Alex Mayo
(Department of Chemistry and Biomolecular Sciences)
T
Tom K. Woo
(Department of Chemistry and Biomolecular Sciences)
Article Details
Volume / Issue
Vol. 147, Issue 21
Published
May 28, 2025
Pages
17579-17583
ISSN
0002-7863
Publisher
American Chemical Society
Journal Info
Journal of the American Chemical Society
American Chemical Society
ISSN: 0002-7863 Physical Sciences
Authors (5)
A
Andrew J. White
Department of Chemistry and Biomolecular Sciences
M
Marco Gibaldi
Department of Chemistry and Biomolecular Sciences
J
Jake Burner
Department of Chemistry and Biomolecular Sciences
R
R. Alex Mayo
Department of Chemistry and Biomolecular Sciences
T
Tom K. Woo
Department of Chemistry and Biomolecular Sciences
Related Articles from this Journal
Rational Design of the Composite Perfluoro-Sulfonic Ionomer for High-Performance Proton Exchange Membrane Fuel Cells
Tingting Mao, Haiyang Fan et al.
Jul 2026
10.1021/jacs.6c05625
Ti3+-O Acid–Base Pairs for Efficient Solar-Driven Photothermal Nonoxidative Ethane Dehydrogenation
Yuwen Sun, Kun Gong et al.
Jul 2026
10.1021/jacs.6c08665
Total Synthesis of Benthol A: Evidence for a Structure Revision
Guanghao Huang, Andrea Tomio et al.
Jul 2026
10.1021/jacs.6c05580
Accelerated Self-Photopolymerization of Phenolics in Microdroplets Contributes to the Brown Carbon Formation
Haoran Yu, Xinrui Yang et al.
Jul 2026
10.1021/jacs.6c10186
Deciphering the Specificity of Reversible DNA-Phosphate ADP-Ribosylation via the Precise Synthesis and Enzymatic Profiling of Nucleotide-Phospho-ADP-Ribosyl Probes
Lingxiao Liu, Yang Lu et al.
Jul 2026
10.1021/jacs.6c02874