标题
Capture of pure toxic gases through porous materials from molecular simulations
作者
关键词
-
出版物
MOLECULAR PHYSICS
Volume 116, Issue 15-16, Pages 2095-2107
出版商
Informa UK Limited
发表日期
2018-02-27
DOI
10.1080/00268976.2018.1440019
参考文献
相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。- A Comprehensive Set of High-Quality Point Charges for Simulations of Metal–Organic Frameworks
- (2016) Dalar Nazarian et al. CHEMISTRY OF MATERIALS
- Capture of H 2 S and SO 2 from trace sulfur containing gas mixture by functionalized UiO-66(Zr) materials: A molecular simulation study
- (2016) Zhi Li et al. FLUID PHASE EQUILIBRIA
- Efficient identification of hydrophobic MOFs: application in the capture of toxic industrial chemicals
- (2016) Peyman Z. Moghadam et al. Journal of Materials Chemistry A
- Metal–organic frameworks for the control and management of air quality: advances and future direction
- (2016) Pawan Kumar et al. Journal of Materials Chemistry A
- Selective capture of trace sulfur gas by porous covalent-organic materials
- (2015) Hui Wang et al. CHEMICAL ENGINEERING SCIENCE
- Understanding Hydrogen Sorption in In-soc-MOF: A Charged Metal-Organic Framework with Open-Metal Sites, Narrow Channels, and Counterions
- (2015) Tony Pham et al. CRYSTAL GROWTH & DESIGN
- Understanding the Effects of Preadsorbed Perfluoroalkanes on the Adsorption of Water and Ammonia in MOFs
- (2015) Peyman Z. Moghadam et al. Journal of Physical Chemistry C
- Computational screening of porous metal-organic frameworks and zeolites for the removal of SO2and NOxfrom flue gases
- (2014) Weizhen Sun et al. AICHE JOURNAL
- Metal–Organic Frameworks for Air Purification of Toxic Chemicals
- (2014) Jared B. DeCoste et al. CHEMICAL REVIEWS
- Toxic gas removal – metal–organic frameworks for the capture and degradation of toxic gases and vapours
- (2014) Elisa Barea et al. CHEMICAL SOCIETY REVIEWS
- Water-Stable Zirconium-Based Metal-Organic Framework Material with High-Surface Area and Gas-Storage Capacities
- (2014) Oleksii V. Gutov et al. CHEMISTRY-A EUROPEAN JOURNAL
- Construction and Characterization of Structure Models of Crystalline Porous Polymers
- (2014) Richard Luis Martin et al. CRYSTAL GROWTH & DESIGN
- Zeolite screening for the separation of gas mixtures containing SO2, CO2and CO
- (2014) I. Matito-Martos et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Computational screening of porous carbons, zeolites, and metal organic frameworks for desulfurization and decarburization of biogas, natural gas, and flue gas
- (2013) Xuan Peng et al. AICHE JOURNAL
- Nitric Oxide Adsorption and Delivery in Flexible MIL-88(Fe) Metal–Organic Frameworks
- (2013) A. C. McKinlay et al. CHEMISTRY OF MATERIALS
- Predicting adsorption of n-perfluorohexane in BCR-704 by molecular simulation
- (2013) Li Yang et al. FLUID PHASE EQUILIBRIA
- Experiences with the publicly available multipurpose simulation code, Music
- (2013) Shaji Chempath et al. MOLECULAR SIMULATION
- Adsorption of hydrogen sulphide on Metal-Organic Frameworks
- (2013) Juan José Gutiérrez-Sevillano et al. RSC Advances
- A Series of Isoreticular, Highly Stable, Porous Zirconium Oxide Based Metal-Organic Frameworks
- (2012) V. Guillerm et al. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
- Metal–organic frameworks for the storage and delivery of biologically active hydrogen sulfide
- (2012) Phoebe K. Allan et al. DALTON TRANSACTIONS
- Adsorptive removal of hazardous materials using metal-organic frameworks (MOFs): A review
- (2012) Nazmul Abedin Khan et al. JOURNAL OF HAZARDOUS MATERIALS
- An Extended Charge Equilibration Method
- (2012) Christopher E. Wilmer et al. Journal of Physical Chemistry Letters
- Interactions of NO2 with Zr-Based MOF: Effects of the Size of Organic Linkers on NO2 Adsorption at Ambient Conditions
- (2012) Amani M. Ebrahim et al. LANGMUIR
- A zinc(ii) metal–organic framework based on triazole and dicarboxylate ligands for selective adsorption of hexane isomers
- (2011) Yun Ling et al. CHEMICAL COMMUNICATIONS
- Modulated Synthesis of Zr-Based Metal-Organic Frameworks: From Nano to Single Crystals
- (2011) Andreas Schaate et al. CHEMISTRY-A EUROPEAN JOURNAL
- Addressing Challenges of Identifying Geometrically Diverse Sets of Crystalline Porous Materials
- (2011) Richard Luis Martin et al. Journal of Chemical Information and Modeling
- Molecular Insight into the Adsorption of H2S in the Flexible MIL-53(Cr) and Rigid MIL-47(V) MOFs: Infrared Spectroscopy Combined to Molecular Simulations
- (2011) Lomig Hamon et al. Journal of Physical Chemistry C
- Stability Effects on CO2Adsorption for the DOBDC Series of Metal–Organic Frameworks
- (2011) Jian Liu et al. LANGMUIR
- Algorithms and tools for high-throughput geometry-based analysis of crystalline porous materials
- (2011) Thomas F. Willems et al. MICROPOROUS AND MESOPOROUS MATERIALS
- Reactive Adsorption of NO2 on Copper-Based Metal−Organic Framework and Graphite Oxide/Metal−Organic Framework Composites
- (2010) Benoit Levasseur et al. ACS Applied Materials & Interfaces
- MOF-74 building unit has a direct impact on toxic gas adsorption
- (2010) T. Grant Glover et al. CHEMICAL ENGINEERING SCIENCE
- Dipyrrin based homo- and hetero-metallic infinite architectures
- (2010) Stéphane A. Baudron CRYSTENGCOMM
- Molecular Simulations and Experimental Studies of CO2, CO, and N2 Adsorption in Metal−Organic Frameworks
- (2010) Jagadeswara R. Karra et al. Journal of Physical Chemistry C
- Grand-Canonical Monte Carlo and Molecular-Dynamics Simulations of Carbon-Dioxide and Carbon-Monoxide Adsorption in Zeolitic Imidazolate Framework Materials
- (2010) Andrew Sirjoosingh et al. Journal of Physical Chemistry C
- Evaluation of the BET Method for Determining Surface Areas of MOFs and Zeolites that Contain Ultra-Micropores
- (2010) Youn-Sang Bae et al. LANGMUIR
- De novo synthesis of a metal–organic framework material featuring ultrahigh surface area and gas storage capacities
- (2010) Omar K. Farha et al. Nature Chemistry
- Ultrahigh Porosity in Metal-Organic Frameworks
- (2010) H. Furukawa et al. SCIENCE
- Selective gas adsorption and separation in metal–organic frameworks
- (2009) Jian-Rong Li et al. CHEMICAL SOCIETY REVIEWS
- Stabilization of Metal−Organic Frameworks with High Surface Areas by the Incorporation of Mesocavities with Microwindows
- (2009) Dan Zhao et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- A Crystalline Imine-Linked 3-D Porous Covalent Organic Framework
- (2009) Fernando J. Uribe-Romo et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Screening of Metal−Organic Frameworks for Carbon Dioxide Capture from Flue Gas Using a Combined Experimental and Modeling Approach
- (2009) A. Özgür Yazaydın et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Highly efficient separation of carbon dioxide by a metal-organic framework replete with open metal sites
- (2009) D. Britt et al. PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
- Thermodynamic Behavior of the CO2+ NO2/N2O4Mixture: A Monte Carlo Simulation Study
- (2008) Emeric Bourasseau et al. JOURNAL OF PHYSICAL CHEMISTRY B
- Crystals as Molecules: Postsynthesis Covalent Functionalization of Zeolitic Imidazolate Frameworks
- (2008) William Morris et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- An optimised molecular model for ammonia
- (2008) Bernhard Eckl et al. MOLECULAR PHYSICS
- Colossal cages in zeolitic imidazolate frameworks as selective carbon dioxide reservoirs
- (2008) Bo Wang et al. NATURE
- Metal-organic frameworks with high capacity and selectivity for harmful gases
- (2008) D. Britt et al. PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA
- High-Throughput Synthesis of Zeolitic Imidazolate Frameworks and Application to CO2Capture
- (2008) Rahul Banerjee et al. SCIENCE
Create your own webinar
Interested in hosting your own webinar? Check the schedule and propose your idea to the Peeref Content Team.
Create NowAsk a Question. Answer a Question.
Quickly pose questions to the entire community. Debate answers and get clarity on the most important issues facing researchers.
Get Started