ARC–MOF: A Diverse Database of Metal-Organic Frameworks with DFT
Por um escritor misterioso
Last updated 09 abril 2025

Two-dimensional UMAP projection of descriptors of a varying number of

Revisiting the MIL-101 metal–organic framework: design, synthesis, modifications, advances, and recent applications - Journal of Materials Chemistry A (RSC Publishing) DOI:10.1039/D1TA06238G

ARC–MOF: A Diverse Database of Metal-Organic Frameworks with DFT-Derived Partial Atomic Charges and Descriptors for Machine Learning

Recent trends on density functional theory–assisted calculations of structures and properties of metal–organic frameworks and metal–organic frameworks-derived nanocarbons, Journal of Materials Research

Recent advances in computational modeling of MOFs: From molecular simulations to machine learning - ScienceDirect
Large-Scale Refinement of Metal−Organic Framework Structures Using Density Functional Theory

Number of structures containing two or more types of arti

ARC–MOF: A Diverse Database of Metal-Organic Frameworks with DFT-Derived Partial Atomic Charges and

Capturing snapshots of post-synthetic metallation chemistry in metal–organic frameworks

Expanding Linker Dimensionality in Metal‐organic Frameworks for sub‐Ångstrom Pore Control for Separation Applications - Macreadie - 2023 - Angewandte Chemie - Wiley Online Library

ARC–MOF: A Diverse Database of Metal-Organic Frameworks with DFT-Derived Partial Atomic Charges and Descriptors for Machine Learning

Expanding Linker Dimensionality in Metal‐organic Frameworks for sub‐Ångstrom Pore Control for Separation Applications - Macreadie - 2023 - Angewandte Chemie International Edition - Wiley Online Library

Expanding Linker Dimensionality in Metal‐organic Frameworks for sub‐Ångstrom Pore Control for Separation Applications - Macreadie - 2023 - Angewandte Chemie International Edition - Wiley Online Library

Diversifying Databases of Metal Organic Frameworks for High-Throughput Computational Screening

Chemosensors, Free Full-Text
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