화학공학소재연구정보센터
검색결과 : 11건
No. Article
1 Analysis of the statistical and convergence properties of ionic transport coefficients with application to the solid electrolyte Li2OHCl
Howard JD, Holzwarth NAW
Solid State Ionics, 325, 80, 2018
2 Li14P2O3N6 and Li7PN4: Computational study of two nitrogen rich crystalline LiPON electrolyte materials
Al-Qawasmeh A, Holzwarth NAW
Journal of Power Sources, 364, 410, 2017
3 Li4SnS4 and Li4SnSe4: Simulations of Their Structure and Electrolyte Properties
Al-Qawasmeh A, Howard J, Holzwarth NAW
Journal of the Electrochemical Society, 164(1), A6386, 2017
4 Computational Study of Li Ion Electrolytes Composed of Li3AsS4 Alloyed with Li4GeS4
Al-Qawasmeh A, Holzwarth NAW
Journal of the Electrochemical Society, 163(9), A2079, 2016
5 Reproducibility in density functional theory calculations of solids
Lejaeghere K, Bihlmayer G, Bjorkman T, Blaha P, Blugel S, Blum V, Caliste D, Castelli IE, Clark SJ, Dal Corso A, de Gironcoli S, Deutsch T, Dewhurst JK, Di Marco I, Draxl C, Dulak M, Eriksson O, Flores-Livas JA, Garrity KF, Genovese L, Giannozzi P, Giantomassi M, Goedecker S, Gonze X, Granas O, Gross EKU, Gulans A, Gygi F, Hamann DR, Hasnip PJ, Holzwarth NAW, Iusan D, Jochym DB, Jollet F, Jones D, Kresse G, Koepernik K, Kucukbenli E, Kvashnin YO, Locht ILM, Lubeck S, Marsman M, Marzari N, Nitzsche U, Nordstrom L, Ozaki T, Paulatto L, Pickard CJ, Poelmans W, Probert MIJ, Refson K, Richter M, Rignanese GM, Saha S, Scheffler M, Schlipf M, Schwarz K, Sharma S, Tavazza F, Thunstrom P, Tkatchenko A, Torrent M, Vanderbilt D, van Setten MJ, Van Speybroeck V, Wills JM, Yates JR, Zhang GX, Cottenier S
Science, 351(6280), 1415, 2016
6 Structural and electrolyte properties of Li4P2S6
Hood ZD, Kates C, Kirkham M, Adhikari S, Liang CD, Holzwarth NAW
Solid State Ionics, 284, 61, 2016
7 First principles investigation of the structural and electrochemical properties of Na4P2S6 and Li4P2S6
Rush LE, Holzwarth NAW
Solid State Ionics, 286, 45, 2016
8 A new crystalline LiPON electrolyte: Synthesis, properties, and electronic structure
Senevirathne K, Day CS, Gross MD, Lachgar A, Holzwarth NAW
Solid State Ionics, 233, 95, 2013
9 Computer Modeling of Crystalline Electrolytes: Lithium Thiophosphates and Phosphates
Lepley ND, Holzwarth NAW
Journal of the Electrochemical Society, 159(5), A538, 2012
10 Computer modeling of lithium phosphate and thiophosphate electrolyte materials
Holzwarth NAW, Lepley ND, Du YA
Journal of Power Sources, 196(16), 6870, 2011