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Strong-field ionization of lithium
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Electrical Energy Storage and Intercalation Chemistry
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Advances in LiTiS2 cell technology
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Chemistry of intercalation compounds: Metal guests in chalcogenide hosts
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Synthesis and properties of lithium-graphite intercalation compounds
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Alternate synthesis and reflectivity spectrum of stage 1 lithium—graphite intercalation compound
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Synthesis and high rate properties of nanoparticled lithium cobalt oxides as the cathode material for lithium-ion battery
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Reactions of metallic Li or LiC 6 with organic solvents for lithium ion battery
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Dielectric Constant, Dipole Moment, and Solubility Parameters of Some Cyclic Acid Esters
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Dielectric properties and relaxation in ethylene carbonate and propylene carbonate
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September 1972 |
Investigation of Binary Mixtures Containing 1-Ethyl-3-methylimidazolium Bis(trifluoromethanesulfonyl)azanide and Ethylene Carbonate
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Transport Properties of LiPF[sub 6]-Based Li-Ion Battery Electrolytes
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LiPF6–EC–EMC electrolyte for Li-ion battery
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Visualizing the chemistry and structure dynamics in lithium-ion batteries by in-situ neutron diffraction
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Recent developments in lithium ion batteries
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Highly reversible Co3O4/graphene hybrid anode for lithium rechargeable batteries
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Fast Parallel Algorithms for Short-Range Molecular Dynamics
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Molecular Dynamics Simulations of Ion-Bombarded Graphene
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Graphene-Based Vibronic Devices
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Calculating the Hydrodynamic Volume of Poly(ethylene oxylated) Single-Walled Carbon Nanotubes and Hydrophilic Carbon Clusters
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Assembly of a Noncovalent DNA Junction on Graphene Sheets and Electron Transport Characteristics
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December 2013 |
Argon-Beam-Induced Defects in a Silica-Supported Single-Walled Carbon Nanotube
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November 2014 |
Density functional theory and molecular dynamics study of the uranyl ion (UO2)2+
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Structure and properties of deeply Li-doped polyacenic semiconductor (PAS)
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Ab Initio Study on Interaction and Stability of Lithium‐Doped Amorphous Carbons
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Computational Studies of Lithium Intercalation in Model Graphite in the Presence of Tetrahydrofuran
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October 1998 |
THEORETICAL STUDY OF LiC 6
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Assessment of lithium ion doping into low crystallized carbonaceous materials using molecular orbital calculations
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Lithium-intercalated graphite: Self-consistent electronic structure for stages one, two, and three
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Layered carbon lattices and their influence on the nature of lithium bonding in lithium intercalated carbon anodes
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Theoretical Studies of Lithium Perchlorate in Ethylene Carbonate, Propylene Carbonate, and Their Mixtures
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Molecular Dynamics Simulation of Li+BF4- in Ethylene Carbonate, Propylene Carbonate, and Dimethyl Carbonate Solvents
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Issues and challenges facing rechargeable lithium batteries
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An ab Initio CFF93 All-Atom Force Field for Polycarbonates
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Density‐functional thermochemistry. III. The role of exact exchange
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Generalized gradient approximation for the exchange-correlation hole of a many-electron system
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Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation
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Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen
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Electron affinities of the first‐row atoms revisited. Systematic basis sets and wave functions
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Benchmark calculations with correlated molecular wave functions. IV. The classical barrier height of the H+H 2 →H 2 +H reaction
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UFF, a full periodic table force field for molecular mechanics and molecular dynamics simulations
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Lithium-Ion Model Behavior in an Ethylene Carbonate Electrolyte Using Molecular Dynamics
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July 2016 |
Halogen bonding and other σ-hole interactions: a perspective
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Halogen bonding: the σ-hole: Proceedings of “Modeling interactions in biomolecules II”, Prague, September 5th–9th, 2005
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Expansion of the σ-hole concept
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Halogen bonding in hypervalent iodine and bromine derivatives: halonium salts
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May 2017 |
Optimized Tersoff and Brenner empirical potential parameters for lattice dynamics and phonon thermal transport in carbon nanotubes and graphene
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Empirical interatomic potential for silicon with improved elastic properties
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November 1988 |
Energy distribution function for the NVT canonical ensemble
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Constant pressure-constant temperature molecular dynamics: a correct constrained NPT ensemble using the molecular virial
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Conductivity of electrolytes for rechargeable lithium batteries
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The state of understanding of the lithium-ion-battery graphite solid electrolyte interphase (SEI) and its relationship to formation cycling
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August 2016 |
Electron Transport and Electrolyte Reduction in the Solid-Electrolyte Interphase of Rechargeable Lithium Ion Batteries with Silicon Anodes
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August 2016 |
Formation and Growth Mechanisms of Solid-Electrolyte Interphase Layers in Rechargeable Batteries
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November 2015 |
Atomistic Modeling of the Electrode–Electrolyte Interface in Li-Ion Energy Storage Systems: Electrolyte Structuring
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February 2013 |
Computational Studies of Interfacial Reactions at Anode Materials: Initial Stages of the Solid-Electrolyte-Interphase Layer Formation
- Ramos-Sanchez, G.; Soto, F. A.; Martinez de la Hoz, J. M.
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Journal of Electrochemical Energy Conversion and Storage, Vol. 13, Issue 3
https://doi.org/10.1115/1.4034412
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August 2016 |
Li Ion Diffusion Mechanisms in Bulk Monoclinic Li 2 CO 3 Crystals from Density Functional Studies
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October 2010 |