Oxygen vacancy promoted methane partial oxidation over iron oxide oxygen carriers in the chemical looping process

DFT+U study of ultrathin α-Fe2O3 nanoribbons from (110) and (104) surfaces

(2016) Prabath Wanaguru et al.   JOURNAL OF APPLIED PHYSICS

Surface-Specific DFT + U Approach Applied to α-Fe2O3(0001)

(2016) Xu Huang et al.   Journal of Physical Chemistry C

Mechanistic and microkinetic analysis of CO2 hydrogenation on ceria

(2016) Zhuo Cheng et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Methane adsorption and dissociation on iron oxide oxygen carriers: the role of oxygen vacancies

(2016) Zhuo Cheng et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Density functional theory study on the reaction between hematite and methane during chemical looping process

(2015) Liang Huang et al.   APPLIED ENERGY

Comprehensive study of Mn–Fe–Al oxygen-carriers for chemical-looping with oxygen uncoupling (CLOU)

(2015) Golnar Azimi et al.   International Journal of Greenhouse Gas Control

Experimental and theoretical study of the oxidation of ventilation air methane over Fe2O3 and CuO

(2015) Yonggang Jin et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

CH4 dissociation on Ni(111): a quantum dynamics study of lattice thermal motion

(2015) Xiangjian Shen et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Density functional theory: Its origins, rise to prominence, and future

(2015) R. O. Jones   REVIEWS OF MODERN PHYSICS

Effect of oxygen vacancy on the adsorption of O 2 on anatase TiO 2 (001): A DFT-based study

(2015) Nguyen Hoang Linh et al.   SURFACE SCIENCE

Nanostructure formation mechanism and ion diffusion in iron–titanium composite materials with chemical looping redox reactions

(2015) Lang Qin et al.   Journal of Materials Chemistry A

Chemical-looping technology platform

(2014) Liang-Shih Fan et al.   AICHE JOURNAL

Chemical looping: To combustion and beyond

(2014) Saurabh Bhavsar et al.   CATALYSIS TODAY

Shale gas-to-syngas chemical looping process for stable shale gas conversion to high purity syngas with a H2 : CO ratio of 2 : 1

(2014) Siwei Luo et al.   Energy & Environmental Science

Propagation of Olefin Metathesis to Propene on WO3 Catalysts: A Mechanistic and Kinetic Study

(2014) Zhuo Cheng et al.   ACS Catalysis

Kinetics of the reduction of hematite (Fe2O3) by methane (CH4) during chemical looping combustion: A global mechanism

(2013) Esmail R. Monazam et al.   CHEMICAL ENGINEERING JOURNAL

Effect of Support Structure and Composition on the Catalytic Activity of Pt Nanoclusters for Methane Dehydrogenation

(2013) Zhuo Cheng et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Carbon dioxide activation and dissociation on ceria (110): A density functional theory study

(2013) Zhuo Cheng et al.   JOURNAL OF CHEMICAL PHYSICS

Quantum state-resolved CH4 dissociation on Pt(111): coverage dependent barrier heights from experiment and density functional theory

(2013) Hirokazu Ueta et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Continuous high purity hydrogen generation from a syngas chemical looping 25kWth sub-pilot unit with 100% carbon capture

(2012) Andrew Tong et al.   FUEL

Dissociative and non-dissociative adsorption dynamics of N2 on Fe(110)

(2012) I. Goikoetxea et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Platinum Nanoclusters Exhibit Enhanced Catalytic Activity for Methane Dehydrogenation

(2012) Zhuo Cheng et al.   TOPICS IN CATALYSIS

Formation of Active Sites on WO3 Catalysts: A Density Functional Theory Study of Olefin Metathesis

(2012) Zhuo Cheng et al.   ACS Catalysis

Paths to which the nudged elastic band converges

(2011) Daniel Sheppard et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Effects of Hydration and Oxygen Vacancy on CO2Adsorption and Activation on β-Ga2O3(100)

(2010) Yun-xiang Pan et al.   LANGMUIR

Synthesis Gas Generation by Chemical-Looping Reforming Using Ce-Based Oxygen Carriers Modified with Fe, Cu, and Mn Oxides

(2009) Fang He et al.   ENERGY & FUELS

Syngas Chemical Looping Gasification Process: Oxygen Carrier Particle Selection and Performance

(2009) Fanxing Li et al.   ENERGY & FUELS

Synthesis gas generation by chemical-looping reforming in a batch fluidized bed reactor using Ni-based oxygen carriers

(2008) Luis F. de Diego et al.   CHEMICAL ENGINEERING JOURNAL

Rotationally invariant ab initio evaluation of Coulomb and exchange parameters for DFT+U calculations

(2008) Nicholas J. Mosey et al.   JOURNAL OF CHEMICAL PHYSICS

DFT models for active sites on high temperature water-gas shift catalysts

(2008) R.M. Van Natter et al.   JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL