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。Quantum-mechanics-based molecular dynamics simulations of the structure and performance of sulfur-enriched Li3PS4 cathodes
Sergey I. Morozov et al.
CELL REPORTS PHYSICAL SCIENCE (2023)
From symmetry breaking in the bulk to phase transitions at the surface: a quantum-mechanical exploration of Li6PS5Cl argyrodite superionic conductor
Maddalena D'Amore et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2022)
The CRYSTAL code, 1976-2020 and beyond, a long story
Roberto Dovesi et al.
JOURNAL OF CHEMICAL PHYSICS (2020)
Composition, crystallography, and oxygen vacancy ordering impacts on the oxygen ion conductivity of lanthanum strontium ferrite
Tridip Das et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2020)
Uniform High Ionic Conducting Lithium Sulfide Protection Layer for Stable Lithium Metal Anode
Hao Chen et al.
ADVANCED ENERGY MATERIALS (2019)
Interface Structure in Li-Metal/[Pyr14][TFSI]-Ionic Liquid System from ab Initio Molecular Dynamics Simulations
Boris V. Merinov et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2019)
Hybrid lithium-ion battery-capacitor energy storage device with hybrid composite cathode based on activated carbon / LiNi0.5Co0.2Mn0.3O2
M. Hagen et al.
JOURNAL OF POWER SOURCES (2019)
Sputter deposition and thermal evaporation of Li2O, Li2S, and Li2Se films
Simon Lorger et al.
JOURNAL OF VACUUM SCIENCE & TECHNOLOGY A (2019)
Status and challenges in enabling the lithium metal electrode for high-energy and low-cost rechargeable batteries
Paul Albertus et al.
NATURE ENERGY (2018)
High-Pressure Phase Diagram and Superionicity of Alkaline Earth Metal Difluorides
Claudio Cazorla et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2018)
Quantum-mechanical condensed matter simulations with CRYSTAL
Roberto Dovesi et al.
WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE (2018)
Review on modeling of the anode solid electrolyte interphase (SEI) for lithium-ion batteries
Aiping Wang et al.
NPJ COMPUTATIONAL MATERIALS (2018)
Reviving the lithium metal anode for high-energy batteries
Dingchang Lin et al.
NATURE NANOTECHNOLOGY (2017)
Theoretical study of superionic phase transition in Li2S
Sara Panahian Jand et al.
SCIENTIFIC REPORTS (2017)
Thermodynamics and kinetics of defects in Li2S
Ashkan Moradabadi et al.
APPLIED PHYSICS LETTERS (2016)
A sulphide lithium super ion conductor is superior to liquid ion conductors for use in rechargeable batteries
Yoshikatsu Seino et al.
ENERGY & ENVIRONMENTAL SCIENCE (2014)
Theoretical guidelines to designing high performance energy storage device based on hybridization of lithium-ion battery and supercapacitor
Hong Soo Choi et al.
JOURNAL OF POWER SOURCES (2014)
Tetragonal Li10GeP2S12 and Li7GePS8 - exploring the Li ion dynamics in LGPS Li electrolytes
Alexander Kuhn et al.
ENERGY & ENVIRONMENTAL SCIENCE (2013)
Formation and conductivity studies of lithium argyrodite solid electrolytes using in-situ neutron diffraction
R. Prasada Rao et al.
SOLID STATE IONICS (2013)
Carbon-sulfur composites for Li-S batteries: status and prospects
Da-Wei Wang et al.
JOURNAL OF MATERIALS CHEMISTRY A (2013)
First Principles Study of the Li10GeP2S12 Lithium Super Ionic Conductor Material
Yifei Mo et al.
CHEMISTRY OF MATERIALS (2012)
Challenges in the development of advanced Li-ion batteries: a review
Vinodkumar Etacheri et al.
ENERGY & ENVIRONMENTAL SCIENCE (2011)
A lithium superionic conductor
Noriaki Kamaya et al.
NATURE MATERIALS (2011)
Lithium batteries: Status, prospects and future
Bruno Scrosati et al.
JOURNAL OF POWER SOURCES (2010)
Li6PS5X: A class of crystalline Li-rich solids with an unusually high Li+ mobility
Hans-Joerg Deiseroth et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2008)
ReaxFF reactive force field for molecular dynamics simulations of hydrocarbon oxidation
Kimberly Chenoweth et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2008)
The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals
Yan Zhao et al.
THEORETICAL CHEMISTRY ACCOUNTS (2008)
Crystal structure of a superionic conductor, Li7P3S11
Hisanori Yamane et al.
SOLID STATE IONICS (2007)
ReaxFF: A reactive force field for hydrocarbons
ACT van Duin et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2001)
Lithium ionic conductor thio-LISICON -: The Li2S-GeS2-P2S5 system
R Kanno et al.
JOURNAL OF THE ELECTROCHEMICAL SOCIETY (2001)