Investigating the Increased CO2 Capture Performance of Amino Acid Functionalized Nanoporous Materials from First-Principles and Grand Canonical Monte Carlo Simulations
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Title
Investigating the Increased CO2 Capture Performance of Amino Acid Functionalized Nanoporous Materials from First-Principles and Grand Canonical Monte Carlo Simulations
Authors
Keywords
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Journal
Journal of Physical Chemistry Letters
Volume 14, Issue 21, Pages 5069-5076
Publisher
American Chemical Society (ACS)
Online
2023-05-25
DOI
10.1021/acs.jpclett.3c00998
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Note: Only part of the references are listed.- Carbon Dioxide Capture Chemistry of Amino Acid Functionalized Metal–Organic Frameworks in Humid Flue Gas
- (2022) Hao Lyu et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Covalently connected core–shell NH2-UiO-66@Br-COFs hybrid materials for CO2 capture and I2 vapor adsorption
- (2022) Jiajia Wang et al. CHEMICAL ENGINEERING JOURNAL
- A review on the adsorption mechanism of different organic contaminants by covalent organic framework (COF) from the aquatic environment
- (2022) Eman Abdelnasser Gendy et al. ENVIRONMENTAL SCIENCE AND POLLUTION RESEARCH
- Functionalized linker to form high-symmetry adsorption sites in micropore COF for CO2 capture and separation: insight from GCMC simulations
- (2022) Huili Xin et al. JOURNAL OF MATERIALS SCIENCE
- Covalent Organic Frameworks for Carbon Dioxide Capture from Air
- (2022) Hao Lyu et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Computational Investigations of Metal–Organic Frameworks as Sorbents for BTEX Removal
- (2022) Robert Stanton et al. Journal of Physical Chemistry Letters
- COF-Based Composites: Extraordinary Removal Performance for Heavy Metals and Radionuclides from Aqueous Solutions
- (2022) He Gu et al. Reviews of Environmental Contamination and Toxicology
- Synthesis and Structure–Property Relationships of Polyimide Covalent Organic Frameworks for Carbon Dioxide Capture and (Aqueous) Sodium-Ion Batteries
- (2021) Remco van der Jagt et al. CHEMISTRY OF MATERIALS
- Selective capture of carbon dioxide from hydrocarbons using a metal-organic framework
- (2021) Omid T. Qazvini et al. Nature Communications
- Efficient Removal of Per- and Polyfluoroalkyl Substances from Water with Zirconium-Based Metal–Organic Frameworks
- (2021) Rui Li et al. CHEMISTRY OF MATERIALS
- Porphyrin- and porphyrinoid-based covalent organic frameworks (COFs): From design, synthesis to applications
- (2021) Minghui Chen et al. COORDINATION CHEMISTRY REVIEWS
- Defect Termination in the UiO-66 Family of Metal–Organic Frameworks: The Role of Water and Modulator
- (2021) Kui Tan et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Influence of Defects and Linker Exchange on Removal of Phosphate Using MOFs with the Node Structure M6(OH)4(O)4 for M = Hf, Zr, or Ce
- (2021) Robert Stanton et al. CHEMISTRY OF MATERIALS
- Amino-functionalized ZIFs-based porous liquids with low viscosity for efficient low-pressure CO2 capture and CO2/N2 separation
- (2021) Xiaoqian Li et al. CHEMICAL ENGINEERING JOURNAL
- Metal–Organic Frameworks against Toxic Chemicals
- (2020) Timur Islamoglu et al. CHEMICAL REVIEWS
- Novel thiol-functionalized covalent organic framework as adsorbent for simultaneous removal of BTEX and mercury (II) from water
- (2020) Yifan Li et al. CHEMICAL ENGINEERING JOURNAL
- Selective CO2 adsorption over functionalized Zr-based metal organic framework under atmospheric or lower pressure: Contribution of functional groups to adsorption
- (2020) Jong Min Park et al. CHEMICAL ENGINEERING JOURNAL
- Construction of a highly heteroatom-functionalized covalent organic framework and its CO2 capture capacity and CO2/N2 selectivity
- (2020) Xiaodong Li et al. MATERIALS LETTERS
- Tailoring Covalent Organic Frameworks to Capture Water Contaminants
- (2019) Soraia P. S. Fernandes et al. CHEMISTRY-A EUROPEAN JOURNAL
- Enhanced hydrothermal stability of Cu MOF by post synthetic modification with amino acids
- (2019) Reetu Rani et al. VACUUM
- Highly Defective UiO-66 Materials for the Adsorptive Removal of Perfluorooctanesulfonate
- (2019) Chelsea A. Clark et al. ACS Sustainable Chemistry & Engineering
- Simultaneous removal of mixed contaminants, copper and norfloxacin, from aqueous solution by ZIF-8
- (2019) Long Zhou et al. CHEMICAL ENGINEERING JOURNAL
- A review on production of metal organic frameworks (MOF) for CO2 adsorption
- (2019) Taravat Ghanbari et al. SCIENCE OF THE TOTAL ENVIRONMENT
- In Silico Design of 2D and 3D Covalent Organic Frameworks for Methane Storage Applications
- (2018) Rocío Mercado et al. CHEMISTRY OF MATERIALS
- MOF-808: A Metal–Organic Framework with Intrinsic Peroxidase-Like Catalytic Activity at Neutral pH for Colorimetric Biosensing
- (2018) He-Qi Zheng et al. INORGANIC CHEMISTRY
- Microwave-assisted synthesis of well-shaped UiO-66-NH 2 with high CO 2 adsorption capacity
- (2018) Aisheng Huang et al. MATERIALS RESEARCH BULLETIN
- Enhancing CO 2 /N 2 adsorption selectivity via post-synthetic modification of NH 2 -UiO-66(Zr)
- (2018) Hossein Molavi et al. MICROPOROUS AND MESOPOROUS MATERIALS
- The role of reticular chemistry in the design of CO2 reduction catalysts
- (2018) Christian S. Diercks et al. NATURE MATERIALS
- Enhanced acidity of defective MOF-808: effects of the activation process and missing linker defects
- (2018) C. Ardila-Suárez et al. Catalysis Science & Technology
- Catalytic properties of pristine and defect-engineered Zr-MOF-808 metal organic frameworks
- (2018) H.-H. Mautschke et al. Catalysis Science & Technology
- UiO-66-NH2/GO Composite: Synthesis, Characterization and CO2 Adsorption Performance
- (2018) Yan Cao et al. Materials
- Fabrication of cellulose nanofibrils/UiO-66-NH2 composite membrane for CO2/N2 separation
- (2018) Xiong-Fei Zhang et al. JOURNAL OF MEMBRANE SCIENCE
- A new UiO-66-NH2 based mixed-matrix membranes with high CO2/CH4 separation performance
- (2018) Yunzhe Jiang et al. MICROPOROUS AND MESOPOROUS MATERIALS
- Amine-Functionalized Covalent Organic Framework for Efficient SO2 Capture with High Reversibility
- (2017) Gang-Young Lee et al. Scientific Reports
- Synthesis of bare and functionalized porous adsorbent materials for CO2 capture
- (2017) Abass A. Olajire Greenhouse Gases-Science and Technology
- Enhanced selectivity in mixed matrix membranes for CO2 capture through efficient dispersion of amine-functionalized MOF nanoparticles
- (2017) Behnam Ghalei et al. Nature Energy
- Emerging Applications of Metal–Organic Frameworks and Covalent Organic Frameworks
- (2016) Yanli Zhao CHEMISTRY OF MATERIALS
- A thiadiazole-functionalized covalent organic framework for efficient CO 2 capture and separation
- (2016) Liangying Wang et al. MICROPOROUS AND MESOPOROUS MATERIALS
- RASPA: molecular simulation software for adsorption and diffusion in flexible nanoporous materials
- (2015) David Dubbeldam et al. MOLECULAR SIMULATION
- Covalent organic frameworks comprising cobalt porphyrins for catalytic CO 2 reduction in water
- (2015) Song Lin et al. SCIENCE
- Metal–Organic Frameworks (MOFs)
- (2014) Hong-Cai “Joe” Zhou et al. CHEMICAL SOCIETY REVIEWS
- The removal of bisphenol A from aqueous solutions by MIL-53(Al) and mesostructured MIL-53(Al)
- (2013) Meimei Zhou et al. JOURNAL OF COLLOID AND INTERFACE SCIENCE
- Covalent organic frameworks
- (2012) Xiao Feng et al. CHEMICAL SOCIETY REVIEWS
- Amino acid functionalized metal–organic frameworks by a soft coupling–deprotection sequence
- (2011) Jerome Canivet et al. CHEMICAL COMMUNICATIONS
- An Evaluation of UiO-66 for Gas-Based Applications
- (2011) Andrew D. Wiersum et al. Chemistry-An Asian Journal
- Algorithms and tools for high-throughput geometry-based analysis of crystalline porous materials
- (2011) Thomas F. Willems et al. MICROPOROUS AND MESOPOROUS MATERIALS
- A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
- (2010) Stefan Grimme et al. JOURNAL OF CHEMICAL PHYSICS
- Electronic structure calculations with GPAW: a real-space implementation of the projector augmented-wave method
- (2010) J Enkovaara et al. JOURNAL OF PHYSICS-CONDENSED MATTER
- Tuning MOF CO2Adsorption Properties via Cation Exchange
- (2010) Jihyun An et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Localized atomic basis set in the projector augmented wave method
- (2009) A. H. Larsen et al. PHYSICAL REVIEW B
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