V. Focused Fundamental Research - EERE - U.S. Department of ...

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Duong – DOE, Srinivasan – LBNL V.A Introduction positive interfaces, development of new overcharge shuttles to further stabilize Li-ion cells, new ionic liquids to enable higher voltage windows, and first principles modeling to understand and eventually to construct a more stable SEI. The Modeling, Diagnostics, and Cell Analysis tasks involve the use of advanced diagnostics techniques, such as FTIR, X-ray absorption fine structure (XAFS), X-ray diffraction (XRD), nuclear magnetic resonance (NMR) and other techniques to investigate interfacial and other properties in Li-ion batteries. Several modeling approaches are used to understand cell and fundamental material properties, including ab-initio calculations, macroscopic cell calculations, and finite element simulations. Finally, standard cell making and testing techniques are developed and applied to provide a common evaluation process for new materials. The BATT program regularly solicits new proposals in each of the above four areas. The 2012 RFP will bein the Modeling, Diagnostics, and Cell Analysis task area. In addition, BATT program management always accepts unsolicited proposals on any advanced energy storage technology that significantly advances the state of the art is is appropriate for the R&D focus of the BATT program. Unsolicited proposals are reviewed in concert with the solicited proposals. FY 2011 Annual Progress Report 469 Energy Storage R&D
V.B Cathode Development V.B.1 First Principles Calculations and NMR Spectroscopy of Electrode Materials (MIT, SUNY) Gerbrand Ceder (Principal Investigator) Department of Materials Science and Engineering Massachusetts Institute of Technology 77 Massachusetts Avenue Cambridge, MA 02139-4307 Clare P. Grey (Co-Principal Investigator) Chemistry Departments University of Cambridge / Stony Brook University Phone: (+44) 1223 336509; Fax: (+44) 1223 336017 E-mail: cpg27@cam.ac.uk Start Date: May 2006 Projected End Date: February 2012 Objectives · Determine the effect of structure on stability and rate capability of cathodes and anodes. · Explore relationships between electro-chemistry and particle size and shape. · Develop new materials. Technical Barriers Low rate capabilities, high cost, poor stability of electrode materials, low energy density. Technical Targets · Specific power 300 W/kg, 10 year life,
Page 1 and 2: V. FOCUSED FUNDAMENTAL RESEARCH Int
Page 3: V.A Introduction Duong - DOE, Srini
Page 7 and 8: V.B.1 First Principles Calculations
Page 9 and 10: V.B.1 First Principles Calculations
Page 11 and 12: V.B.2 Cell Analysis, High-energy De
Page 13 and 14: V.B.3 Olivines and Substituted Laye
Page 19 and 20: V.B.4 Stabilized Spinels and Nano O
Page 21 and 22: V.B.4 Stabilized Spinels and Nano O
Page 23 and 24: V.B.5 The Synthesis and Characteriz
Page 25 and 26: V.B.5 Synthesis & Characterization
Page 27 and 28: V.B.6 Cell Analysis-Interfacial Pro
Page 29 and 30: V.B.6 Cell Analysis-Interfacial Pro
Page 31 and 32: V.B.7 Role of Surface Chemistry on
Page 39 and 40: V.B.8 Characterization of New Catho
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Page 43 and 44: V.B.9 Layered Cathode Materials (AN
Page 49 and 50: V.B.10 Development of High Energy C
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V.B.11 Crystal Studies on High-ener
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V.B.11 Crystal Studies on High-ener
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V.B.12 Developing Materials for Lit
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V.B.13 Studies on the Local SOC and
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V.B.13 Studies on the Local SOC and
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V.B.14 New Cathode Projects (LBNL)
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V.C.1 Nanoscale Composite Hetero-st
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V.C.1 Nanoscale Composite Hetero-st
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V.C.2 Interfacial Processes - Diagn
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V.C.3 Search for New Anode Material
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V.C.4 Nano-structured Materials as
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V.C.4 Nano-structured Materials as
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V.C.5 Development of High Capacity
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V.C.5 Development of High Capacity
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V.C.6 Advanced Binder for Electrode
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V.C.6 Advanced Binder for Electrode
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V.C.7 Three-Dimensional Anode Archi
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ARGONNE2_CDJ403T me Pro ile V.C.7 T
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V.C.8 Metal-Based High-Capacity Li-
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V.C.8 Metal-Based High-Capacity Li-
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V.C.9 New Layered Nanolaminates for
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V.C.9 New Layered Nanolaminates for
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V.C.10 Atomic Layer Deposition for
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V.C.10 Atomic Layer Deposition for
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V.C.11 Synthesis and Characterizati
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V.C.11 Polymer-Coated Layered SiOx-
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V.C.12 Synthesis and Characterizati
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V.C.12 Silicon Clathrates for Anode
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V.C.12 Silicon Clathrates for Anode
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V.C.13 Wiring Up Silicon Nanopartic
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V.C.13 Wiring Up Silicon Nanopartic
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V.C.14 Hard Carbon Materials for Hi
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V.C.14 Hard Carbon Materials for Hi
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V.D.1 Polymer Electrolytes for Adva
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V.D.1 Polymer Electrolytes for Adva
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V.D.2 Interfacial Behavior of Elect
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V.D.2 Interfacial Behavior of Elect
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V.D.3 Molecular Dynamics Simulation
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V.D.3 Molecular Dynamics Simulation
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V.D.4 Bi-functional Electrolytes fo
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V.D.4 Bi-functional Electrolytes fo
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V.D.5 Advanced Electrolyte and Elec
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V.D.6 Inexpensive, Nonfluorinated (
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V.D.6 Nonfluorinated (or Partially
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V.D.7 Development of Electrolytes f
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V.D.8 Sulfones with Additives as El
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V.D.8 Sulfones with Additives as El
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V.D.9 Long-lived Polymer Electrolyt
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V.E Cell Analysis, Modeling, and Fa
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V.E.1 Electrode Fabrication and Fai
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V.E.2 Modeling-Thermo-electrochemis
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V.E.2 Thermo-electrochemistry, Capa
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V.E.3 Intercalation Kinetics and Io
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V.E.4 Mathematical Modeling of Next
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V.E.5 Analysis and Simulation of El
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V.E.5 Analysis and Simulation of El
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V.E.6 Investigation of Critical Par
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V.E.6 Investigation of Critical Par
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V.E.7 Predicting/Understanding New
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V.E.8 New Electrode Designs for Ult
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V.E.8 New Electrode Designs for Ult
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V.E.9 In Situ Electron Spectroscopy
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V.E.9 In situ Electron Spectroscopy
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V.F.1 Energy Frontier Research Cent
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V.F.1 Energy Frontier Research Cent
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V.F.2 Novel In Situ Diagnostics Too
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V.F.2 Novel In Situ Diagnostics Too
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V.G Integrated Lab-Industry Researc
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