Zobrazeno 1 - 10
of 11
pro vyhledávání: '"Robert Ellis Doe"'
Autor:
Robert Ellis Doe, Gerd Ceder, Hyun Deog Yoo, Ivgeni Shterenberg, Doron Aurbach, C.C. Fischer, Yosef Gofer
Publikováno v:
Journal of The Electrochemical Society. 161:A410-A415
Prototype cells of hybrid capacitor were developed, comprising activated carbon (AC) cloth and magnesium (Mg) foil as the positive and negative electrodes, respectively. The electrolyte solution included ether solvent (TBF) and a magnesium organo-hal
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::11c8edd8166883bee777ecd46fdb35dd
https://doi.org/10.1149/2.082403jes
https://doi.org/10.1149/2.082403jes
Publikováno v:
Journal of The Electrochemical Society. 160:A279-A284
We present a layered Li-intercalation oxide that operates on the V3+/V4+ redox couple. The stabilization effect of adding a +3 element into the layered LiVO2 has been studied by first principles calculations. We identified Cr substitution into LiVO2
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::e1038e93971e1c7c1938453959fcf0c9
https://doi.org/10.1149/2.046302jes
https://doi.org/10.1149/2.046302jes
Carbonophosphates: A New Family of Cathode Materials for Li-Ion Batteries Identified Computationally
Autor:
Robert Ellis Doe, Hailong Chen, Yuanzhi Tang, Gerbrand Ceder, Charles J. Moore, Lijun Wu, Byoungwoo Kang, Anubhav Jain, Yimei Zhu, Geoffroy Hautier
Publikováno v:
Chemistry of Materials. 24:2009-2016
The tremendous growth of Li-ion batteries into a wide variety of applications is setting new requirements in terms of cost, energy density, safety, and power density. One route toward meeting these objectives consists in finding alternative chemistri
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::334b339ef8599f0f7d772eec4f31259a
https://doi.org/10.1021/cm203243x
https://doi.org/10.1021/cm203243x
Autor:
Geoffroy Hautier, Charles J. Moore, Gerbrand Ceder, Shyue Ping Ong, Byoungwoo Kang, Robert Ellis Doe, Anubhav Jain
Publikováno v:
Chemistry of Materials. 23:3495-3508
Phosphate materials are being extensively studied as lithium-ion battery electrodes. In this work, we present a high-throughput ab initio analysis of phosphates as cathode materials. Capacity, voltage, specific energy, energy density, and thermal sta
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::cb67fe95516027bd5c45cdd7fd950219
https://doi.org/10.1021/cm200949v
https://doi.org/10.1021/cm200949v
Autor:
Ruoban Han, Hyun Deog Yoo, Ivgeni Shterenberg, Doron Aurbach, Nir Pour, Robert Ellis Doe, Jaehee Hwang, Andrew J. Gmitter
Publikováno v:
Chem. Commun.. 50:243-245
Herein the first inorganic magnesium salt solution capable of highly reversible magnesium electrodeposition is presented. Synthesized by acid-base reaction of MgCl2 and Lewis acidic compounds such as AlCl3, this salt class demonstrates upwards of 99%
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e5038638a53a59f1ac5fae0d07e20c9a
https://doi.org/10.1039/c3cc47896c
https://doi.org/10.1039/c3cc47896c
Publikováno v:
Chemistry of Materials. 20:5274-5283
We have used density functional theory (DFT) to investigate the ternary phase diagram of the Li−Fe−F system and the reactions of Li with iron fluorides. Several novel compounds, not previously identified in the Li−Fe−F system, are predicted t
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::2c294d2e5c74ff0b4aab19e637cddd06
https://doi.org/10.1021/cm801105p
https://doi.org/10.1021/cm801105p
Publikováno v:
Prof. Ceder via Angie Locknar
First-principles studies of iron oxyfluorides in the FeF[subscript 2] rutile framework (FeO[subscript x]F[subscript 2−x], 0≤x≤1) are performed using density functional theory (DFT) in the general gradient approximation (GGA) with a Hubbard U co
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::d82cb0b88bf651f578bc4844970f5866
https://doi.org/10.1103/physrevb.87.094118
https://doi.org/10.1103/physrevb.87.094118
Autor:
Geoffroy Hautier, Robert Ellis Doe, Charles J. Moore, Shyue Ping Ong, Byoungwoo Kang, Anubhav Jain, Gerbrand Ceder
Publikováno v:
ChemInform. 42
Phosphate materials are being extensively studied as lithium-ion battery electrodes. In this work, we present a high-throughput ab initio analysis of phosphates as cathode materials. Capacity, voltage, specific energy, energy density, and thermal sta
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::c9a7235d9d5829622e66b801b417ccbe
https://doi.org/10.1002/chin.201137008
https://doi.org/10.1002/chin.201137008
Publikováno v:
Physical Review B. 80
Multiwalled inorganic nanotubes with circular cross sections must have either an incoherent interface or a large amount of strain. However, nanotubes with a polygonal cross section can have a coherent interface with considerably less strain. We prese
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::91cf946af59c129e49da2f41dbc22262
https://doi.org/10.1103/physrevb.80.014102
https://doi.org/10.1103/physrevb.80.014102
Publikováno v:
Electrochemical and Solid-State Letters. 12:A125
First principles calculations have been used to explore the Li–Bi–F ternary phase diagram. Our results confirm the thermodynamic stability of previously observed phases and find no new phases in this system. Electrochemical voltage profiles for t
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::7acb04ec9c1c156574620c33835ef6f1
https://doi.org/10.1149/1.3117249
https://doi.org/10.1149/1.3117249