Related references
Note: Only part of the references are listed.High-throughput screening platform for solid electrolytes combining hierarchical ion-transport prediction algorithms
Bing He et al.
SCIENTIFIC DATA (2020)
A Database of Ionic Transport Characteristics for Over 29 000 Inorganic Compounds
Liwen Zhang et al.
ADVANCED FUNCTIONAL MATERIALS (2020)
Theoretical Insights into Li-Ion Transport in LiTa2PO8
Fiaz Hussain et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2019)
Stable Lithium Ion Conducting Thiophosphate Solid Electrolytes Lix(PS4)yXz (X = Cl, Br, I)
Rayavarapu Prasada Rao et al.
CHEMISTRY OF MATERIALS (2019)
Machine Learning-Assisted Discovery of Solid Li-Ion Conducting Materials
Austin D. Sendek et al.
CHEMISTRY OF MATERIALS (2019)
SoftBV - a software tool for screening the materials genome of inorganic fast ion conductors
Haomin Chen et al.
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE CRYSTAL ENGINEERING AND MATERIALS (2019)
Ab initio investigation of the stability of electrolyte/electrode interfaces in all-solid-state Na batteries
Valentina Lacivita et al.
JOURNAL OF MATERIALS CHEMISTRY A (2019)
Evaluation of magnesium ion migration in inorganic oxides by the bond valence site energy method
Yu Nishitani et al.
SOLID STATE IONICS (2018)
Experimental Studies on Work Functions of Li+ Ions and Electrons in the Battery Electrode Material LiCoO2: A Thermodynamic Cycle Combining Ionic and Electronic Structure
Stephan Schuld et al.
ADVANCED ENERGY MATERIALS (2018)
NOMAD: The FAIR concept for big data-driven materials science
Claudia Draxl et al.
MRS BULLETIN (2018)
Doping of BiFeO3: A comprehensive study on substitutional doping
Julian Gebhardt et al.
PHYSICAL REVIEW B (2018)
Divalent-doped Na3Zr2Si2PO12 natrium superionic conductor: Improving the ionic conductivity via simultaneously optimizing the phase and chemistry of the primary and secondary phases
Mojtaba Samiee et al.
JOURNAL OF POWER SOURCES (2017)
Bond softness sensitive bond-valence parameters for crystal structure plausibility tests
Haomin Chen et al.
IUCRJ (2017)
Computational Prediction and Evaluation of Solid-State Sodium Superionic Conductors Na7P3X11 (X=0, 5, Se)
Yan Wang et al.
CHEMISTRY OF MATERIALS (2017)
Diffusion Mechanism of Li Argyrodite Solid Electrolytes for Li-Ion Batteries and Prediction of Optimized Halogen Doping: The Effect of Li Vacancies, Halogens, and Halogen Disorder
Niek J. J. de Klerk et al.
CHEMISTRY OF MATERIALS (2016)
An efficient algorithm for finding the minimum energy path for cation migration in ionic materials
Ziqin Rong et al.
JOURNAL OF CHEMICAL PHYSICS (2016)
Cathode properties of sodium iron phosphate glass for sodium ion batteries
Satoshi Nakata et al.
JOURNAL OF NON-CRYSTALLINE SOLIDS (2016)
Na-ion diffusion in a NASICON-type solid electrolyte: a density functional study
Kieu My Bui et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2016)
Lithium Ion Conduction in LiTi2(PO4)3 and Related Compounds Based on the NASICON Structure: A First-Principles Study
Britta Lang et al.
CHEMISTRY OF MATERIALS (2015)
Role of Na+ Interstitials and Dopants in Enhancing the Na+ Conductivity of the Cubic Na3PS4 Superionic Conductor
Zhuoying Zhu et al.
CHEMISTRY OF MATERIALS (2015)
Design principles for solid-state lithium superionic conductors
Yan Wang et al.
NATURE MATERIALS (2015)
Effects of penta- and trivalent dopants on structure and conductivity Of Li7La3Zr2O12
W. Gu et al.
SOLID STATE IONICS (2015)
The Open Quantum Materials Database (OQMD): assessing the accuracy of DFT formation energies
Scott Kirklin et al.
npj Computational Materials (2015)
Visualizing Lithium-Ion Migration Pathways in Battery Materials
Mette O. Filso et al.
CHEMISTRY-A EUROPEAN JOURNAL (2013)
Commentary: The Materials Project: A materials genome approach to accelerating materials innovation
Anubhav Jain et al.
APL MATERIALS (2013)
AFLOW: An automatic framework for high-throughput materials discovery
Stefano Curtarolo et al.
COMPUTATIONAL MATERIALS SCIENCE (2012)
Recent Developments in the Methods and Applications of the Bond Valence Model
Ian David Brown
CHEMICAL REVIEWS (2009)
VESTA:: a three-dimensional visualization system for electronic and structural analysis
Koichi Momma et al.
JOURNAL OF APPLIED CRYSTALLOGRAPHY (2008)
Global instability index optimizations for the localization of mobile protons
S Adams et al.
SOLID STATE IONICS (2004)
The General Utility Lattice Program (GULP)
JD Gale et al.
MOLECULAR SIMULATION (2003)
Share Paper
