DFT insights into the adsorption of NH3-SCR related small gases in Mn-MOF-74

Selective gas capture via kinetic trapping

(2016) Joyjit Kundu et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Small-Molecule Adsorption in Open-Site Metal–Organic Frameworks: A Systematic Density Functional Theory Study for Rational Design

(2015) Kyuho Lee et al.   CHEMISTRY OF MATERIALS

Competitive Coadsorption of CO2 with H2O, NH3, SO2, NO, NO2, N2, O2, and CH4 in M-MOF-74 (M = Mg, Co, Ni): The Role of Hydrogen Bonding

(2015) Kui Tan et al.   CHEMISTRY OF MATERIALS

Water Reaction Mechanism in Metal Organic Frameworks with Coordinatively Unsaturated Metal Ions: MOF-74

(2014) Kui Tan et al.   CHEMISTRY OF MATERIALS

Identifying active sites for fast NH3-SCR of NO/NO2 mixtures over Fe-ZSM-5 by operando EPR and UV–vis spectroscopy

(2014) Roxana Pérez Vélez et al.   JOURNAL OF CATALYSIS

Crystallization-Induced Energy Level Change of [6,6]-Phenyl-C61-Butyric Acid Methyl Ester (PCBM) Film: Impact of Electronic Polarization Energy

(2014) Yufei Zhong et al.   Journal of Physical Chemistry C

Water Adsorption in Porous Metal–Organic Frameworks and Related Materials

(2014) Hiroyasu Furukawa et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Porous metal–organic framework MIL-100(Fe) as an efficient catalyst for the selective catalytic reduction of NOx with NH3

(2014) Peng Wang et al.   RSC Advances

Morphology-Dependent Properties of MnOx/ZrO2–CeO2 Nanostructures for the Selective Catalytic Reduction of NO with NH3

(2013) Ruihua Gao et al.   Journal of Physical Chemistry C

Fundamental Aspects of H2S Adsorption on CPO-27-Ni

(2013) Sachin Chavan et al.   Journal of Physical Chemistry C

Electrical and Photoresponse Properties of Printed Thin-Film Transistors Based on Poly(9,9-dioctylfluorene-co-bithiophene) Sorted Large-Diameter Semiconducting Carbon Nanotubes

(2013) Long Qian et al.   Journal of Physical Chemistry C

Water Cluster Confinement and Methane Adsorption in the Hydrophobic Cavities of a Fluorinated Metal–Organic Framework

(2013) Nour Nijem et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

When metal organic frameworks turn into linear magnets

(2013) Pieremanuele Canepa et al.   PHYSICAL REVIEW B

Diffusion of Small Molecules in Metal Organic Framework Materials

(2013) Pieremanuele Canepa et al.   PHYSICAL REVIEW LETTERS

High-throughput screening of small-molecule adsorption in MOF

(2013) Pieremanuele Canepa et al.   Journal of Materials Chemistry A

The effect of water adsorption on the structure of the carboxylate containing metal–organic frameworks Cu-BTC, Mg-MOF-74, and UiO-66

(2013) Jared B. DeCoste et al.   Journal of Materials Chemistry A

Effect of Water Adsorption on Retention of Structure and Surface Area of Metal–Organic Frameworks

(2012) Paul M. Schoenecker et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

How Well Do Metal–Organic Frameworks Tolerate Flue Gas Impurities?

(2012) Lifeng Ding et al.   Journal of Physical Chemistry C

Trace Flue Gas Contaminants Poison Coordinatively Unsaturated Metal–Organic Frameworks: Implications for CO2 Adsorption and Separation

(2012) Kuang Yu et al.   Journal of Physical Chemistry C

Synchrotron X-ray studies of metal-organic framework M 2(2,5-dihydroxyterephthalate), M = (Mn, Co, Ni, Zn) (MOF74)

(2012) W. Wong-Ng et al.   POWDER DIFFRACTION

In situ DRIFTS study of NO reduction by NH3 over Fe–Ce–Mn/ZSM-5 catalysts

(2011) Guangying Zhou et al.   CATALYSIS TODAY

Structure–activity relationships of simple molecules adsorbed on CPO-27-Ni metal–organic framework: In situ experiments vs. theory

(2011) L. Valenzano et al.   CATALYSIS TODAY

Catalytic NOxAbatement Systems for Mobile Sources: From Three-Way to Lean Burn after-Treatment Technologies

(2011) Pascal Granger et al.   CHEMICAL REVIEWS

MOF-74 building unit has a direct impact on toxic gas adsorption

(2010) T. Grant Glover et al.   CHEMICAL ENGINEERING SCIENCE

DRIFT Study on Cerium−Tungsten/Titiania Catalyst for Selective Catalytic Reduction of NOxwith NH3

(2010) Liang Chen et al.   ENVIRONMENTAL SCIENCE & TECHNOLOGY

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

Effect of manganese substitution on the structure and activity of iron titanate catalyst for the selective catalytic reduction of NO with NH3

(2009) Fudong Liu et al.   APPLIED CATALYSIS B-ENVIRONMENTAL

High-Capacity Methane Storage in Metal−Organic Frameworks M2(dhtp): The Important Role of Open Metal Sites

(2009) Hui Wu et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Local Structure of CPO-27-Ni Metallorganic Framework upon Dehydration and Coordination of NO

(2008) Francesca Bonino et al.   CHEMISTRY OF MATERIALS

Size-Selective Lewis Acid Catalysis in a Microporous Metal-Organic Framework with Exposed Mn2+Coordination Sites

(2008) Satoshi Horike et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Enhanced H2Adsorption in Isostructural Metal−Organic Frameworks with Open Metal Sites: Strong Dependence of the Binding Strength on Metal Ions

(2008) Wei Zhou et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Selective catalytic reduction of NO with NH3 at low temperatures over iron and manganese oxides supported on mesoporous silica

(2007) Jihui Huang et al.   APPLIED CATALYSIS B-ENVIRONMENTAL

Hybrid porous solids: past, present, future

(2007) Gérard Férey   CHEMICAL SOCIETY REVIEWS