DFT simulations of 7Li solid state NMR spectral parameters and Li+ ion migration barriers in Li2ZrO3

Study on Tritium Release Behavior from Li2ZrO3

(2017) T. Kanazawa et al.   FUSION SCIENCE AND TECHNOLOGY

High temperature CO2 sorbents and their application for hydrogen production by sorption enhanced steam reforming process

(2016) Marziehossadat Shokrollahi Yancheshmeh et al.   CHEMICAL ENGINEERING JOURNAL

Lithium zirconate as solid catalyst for simultaneous esterification and transesterification of low quality triglycerides

(2015) Navjot Kaur et al.   APPLIED CATALYSIS A-GENERAL

Improvement of high voltage electrochemical performance of LiNi0.5Co0.2Mn0.3O2 cathode materials via Li2ZrO3 coating

(2015) Ding Wang et al.   CERAMICS INTERNATIONAL

Electrochemical performance and lithium-ion insertion/extraction mechanism studies of the novel Li2ZrO3 anode materials

(2015) Youzhong Dong et al.   ELECTROCHIMICA ACTA

Improved electrochemical and thermal performances of layered Li[Li 0.2 Ni 0.17 Co 0.07 Mn 0.56 ]O 2 via Li 2 ZrO 3 surface modification

(2015) Xiaoping Zhang et al.   JOURNAL OF POWER SOURCES

Lithium and lithium ion batteries for applications in microelectronic devices: A review

(2015) Yuxing Wang et al.   JOURNAL OF POWER SOURCES

Regeneration mechanisms of high-lithium content zirconates as CO2 capture sorbents: experimental measurements and theoretical investigations

(2015) Yuhua Duan et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Effective enhancement of electrochemical performance for spherical spinel LiMn2O4 via Li ion conductive Li2ZrO3 coating

(2014) Xin Yi et al.   ELECTROCHIMICA ACTA

High Temperature CO2 Sorption on Li2ZrO3 Based Sorbents

(2014) Chao Wang et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Li2ZrO3-coated 0.4Li2MnO3·0.6LiNi1/3Co1/3Mn1/3O2 for high performance cathode material in lithium-ion battery

(2014) Xiaowei Miao et al.   JOURNAL OF POWER SOURCES

Electrical and lithium ion dynamics in Li2IrO3 from density functional theory study

(2014) Yongchang Chen et al.   RSC Advances

Error Estimates for Solid-State Density-Functional Theory Predictions: An Overview by Means of the Ground-State Elemental Crystals

(2013) K. Lejaeghere et al.   CRITICAL REVIEWS IN SOLID STATE AND MATERIALS SCIENCES

Li2ZrO3 coated LiNi1/3Co1/3Mn1/3O2 for high performance cathode material in lithium batteries

(2013) Chunguang Wang et al.   ELECTROCHIMICA ACTA

Charge transport in lithium peroxide: relevance for rechargeable metal–air batteries

(2013) Maxwell D. Radin et al.   Energy & Environmental Science

Ultraslow Li Exchange Processes in Diamagnetic Li2ZrO3 As Monitored by EXSY NMR

(2013) P. Bottke et al.   Journal of Physical Chemistry C

Localization of vacancies and mobility of lithium ions in Li2ZrO3 as obtained by 6,7Li NMR

(2013) Ya. V. Baklanova et al.   JOURNAL OF SOLID STATE CHEMISTRY

Structural and electronic properties of Li8ZrO6 and its CO2 capture capabilities: an ab initio thermodynamic approach

(2013) Yuhua Duan   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Comparison study on strategies to prepare nanocrystalline Li2ZrO3-based absorbents for CO2 capture at high temperatures

(2013) Qiang Xiao et al.   Frontiers of Chemical Science and Engineering

First-Principles Calculation of NMR Parameters Using the Gauge Including Projector Augmented Wave Method: A Chemist’s Point of View

(2012) Christian Bonhomme et al.   CHEMICAL REVIEWS

Syntheses and structures of lithium zirconates for high-temperature CO2 absorption

(2012) Shutao Wang et al.   Journal of Materials Chemistry A

Reactor modeling of sorption-enhanced autothermal reforming of methane. Part I: Performance study of hydrotalcite and lithium zirconate-based processes

(2011) M.H. Halabi et al.   CHEMICAL ENGINEERING JOURNAL

A citrate sol–gel method to synthesize Li2ZrO3 nanocrystals with improved CO2 capture properties

(2011) Qiang Xiao et al.   JOURNAL OF MATERIALS CHEMISTRY

Ab initio27Al NMR chemical shifts and quadrupolar parameters for Al2O3phases and their precursors

(2011) Ary R. Ferreira et al.   PHYSICAL REVIEW B

The PAW/GIPAW approach for computing NMR parameters: A new dimension added to NMR study of solids

(2011) Thibault Charpentier   SOLID STATE NUCLEAR MAGNETIC RESONANCE

Effect of Oxygen Addition on the Thermokinetic Properties of CO2Chemisorption on Li2ZrO3

(2010) Lorena Martínez-dlCruz et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Electrochemical properties of Li2ZrO3-coated silicon/graphite/carbon composite as anode material for lithium ion batteries

(2008) Ming-Qi Li et al.   JOURNAL OF POWER SOURCES

Restoring the Density-Gradient Expansion for Exchange in Solids and Surfaces

(2008) John P. Perdew et al.   PHYSICAL REVIEW LETTERS

Insights into Current Limitations of Density Functional Theory

(2008) A. J. Cohen et al.   SCIENCE