-
1
-
-
84875641198
-
Lithium-Oxygen Batteries: Bridging Mechanistic Understanding and Battery Performance
-
Lu, Y. C.; Gallant, B. M.; Kwabi, D. G.; Harding, J. R.; Mitchell, R. R.; Whittingham, M. S.; Shao-Horn, Y. Lithium-Oxygen Batteries: Bridging Mechanistic Understanding and Battery Performance Energy Environ. Sci. 2013, 6, 750-768
-
(2013)
Energy Environ. Sci.
, vol.6
, pp. 750-768
-
-
Lu, Y.C.1
Gallant, B.M.2
Kwabi, D.G.3
Harding, J.R.4
Mitchell, R.R.5
Whittingham, M.S.6
Shao-Horn, Y.7
-
2
-
-
58149183219
-
The Electrochemical Energy Storage: Contribution of the Rechargeable Lithium-Ion Batteries
-
Franger, S.; Benoit, C.; Saint-Martin, R. The Electrochemical Energy Storage: Contribution of the Rechargeable Lithium-Ion Batteries Actual. Chim. 2008, 41-44
-
(2008)
Actual. Chim.
, pp. 41-44
-
-
Franger, S.1
Benoit, C.2
Saint-Martin, R.3
-
3
-
-
0035890440
-
Issues and Challenges Facing Rechargeable Lithium Batteries
-
Tarascon, J. M.; Armand, M. Issues and Challenges Facing Rechargeable Lithium Batteries Nature 2001, 414, 359-367
-
(2001)
Nature
, vol.414
, pp. 359-367
-
-
Tarascon, J.M.1
Armand, M.2
-
4
-
-
0000737644
-
Recent Advances in Lithium Ion Battery Materials
-
Scrosati, B. Recent Advances in Lithium Ion Battery Materials Electrochim. Acta 2000, 45, 2461-2466
-
(2000)
Electrochim. Acta
, vol.45
, pp. 2461-2466
-
-
Scrosati, B.1
-
5
-
-
84867295154
-
Recent Progress in Aqueous Lithium-Ion Batteries
-
Wang, Y. G.; Yi, J.; Xia, Y. Y. Recent Progress in Aqueous Lithium-Ion Batteries Adv. Energy Mater. 2012, 2, 830-840
-
(2012)
Adv. Energy Mater.
, vol.2
, pp. 830-840
-
-
Wang, Y.G.1
Yi, J.2
Xia, Y.Y.3
-
6
-
-
29444442081
-
NMR Investigation of Ionic Liquid-Lix Mixtures: Pyrrolidinium Cations and Tfsi- Anions
-
Nicotera, I.; Oliviero, C.; Henderson, W. A.; Appetecchi, G. B.; Passerini, S. NMR Investigation of Ionic Liquid-Lix Mixtures: Pyrrolidinium Cations and Tfsi- Anions J. Phys. Chem. B 2005, 109, 22814-22819
-
(2005)
J. Phys. Chem. B
, vol.109
, pp. 22814-22819
-
-
Nicotera, I.1
Oliviero, C.2
Henderson, W.A.3
Appetecchi, G.B.4
Passerini, S.5
-
7
-
-
33745713390
-
Structure and Dynamics of N-Methyl-N-Propylpyrrolidinium Bis(Trifluoromethanesulfonyl)Imide Ionic Liquid from Molecular Dynamics Simulations
-
Borodin, O.; Smith, G. D. Structure and Dynamics of N-Methyl-N- Propylpyrrolidinium Bis(Trifluoromethanesulfonyl)Imide Ionic Liquid from Molecular Dynamics Simulations J. Phys. Chem. B 2006, 110, 11481-11490
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 11481-11490
-
-
Borodin, O.1
Smith, G.D.2
-
8
-
-
70349307529
-
Transport Properties of Ionic Liquid Electrolytes with Organic Diluents
-
Bayley, P. M.; Lane, G. H.; Rocher, N. M.; Clare, B. R.; Best, A. S.; MacFarlane, D. R.; Forsyth, M. Transport Properties of Ionic Liquid Electrolytes with Organic Diluents Phys. Chem. Chem. Phys. 2009, 11, 7202-7208
-
(2009)
Phys. Chem. Chem. Phys.
, vol.11
, pp. 7202-7208
-
-
Bayley, P.M.1
Lane, G.H.2
Rocher, N.M.3
Clare, B.R.4
Best, A.S.5
MacFarlane, D.R.6
Forsyth, M.7
-
9
-
-
77956093265
-
Molecular Dynamics Simulation of Model Room Temperature Ionic Liquids with Divalent Anions
-
Raju, S. G.; Balasubramanian, S. Molecular Dynamics Simulation of Model Room Temperature Ionic Liquids with Divalent Anions Indian J. Chem., Sect. A: Inorg., Bio-inorg., Phys., Theor. Anal. Chem. 2010, 49, 721-726
-
(2010)
Indian J. Chem., Sect. A: Inorg., Bio-inorg., Phys., Theor. Anal. Chem.
, vol.49
, pp. 721-726
-
-
Raju, S.G.1
Balasubramanian, S.2
-
10
-
-
33749618633
-
Tail Aggregation and Domain Diffusion in Ionic Liquids
-
Wang, Y. T.; Voth, G. A. Tail Aggregation and Domain Diffusion in Ionic Liquids J. Phys. Chem. B 2006, 110, 18601-18608
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 18601-18608
-
-
Wang, Y.T.1
Voth, G.A.2
-
11
-
-
79951932192
-
The Effect of Coordinating and Non-Coordinating Additives on the Transport Properties in Ionic Liquid Electrolytes for Lithium Batteries
-
Bayley, P. M.; Best, A. S.; MacFarlane, D. R.; Forsyth, M. The Effect of Coordinating and Non-Coordinating Additives on the Transport Properties in Ionic Liquid Electrolytes for Lithium Batteries Phys. Chem. Chem. Phys. 2011, 13, 4632-4640
-
(2011)
Phys. Chem. Chem. Phys.
, vol.13
, pp. 4632-4640
-
-
Bayley, P.M.1
Best, A.S.2
MacFarlane, D.R.3
Forsyth, M.4
-
12
-
-
33745444000
-
Lithium Secondary Batteries Using Modified-Imidazolium Room-Temperature Ionic Liquid
-
Seki, S.; Kobayashi, Y.; Miyashiro, H.; Ohno, Y.; Usami, A.; Mita, Y.; Kihira, N.; Watanabe, M.; Terada, N. Lithium Secondary Batteries Using Modified-Imidazolium Room-Temperature Ionic Liquid J. Phys. Chem. B 2006, 110, 10228-10230
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 10228-10230
-
-
Seki, S.1
Kobayashi, Y.2
Miyashiro, H.3
Ohno, Y.4
Usami, A.5
Mita, Y.6
Kihira, N.7
Watanabe, M.8
Terada, N.9
-
13
-
-
78049245403
-
The Electrochemistry of Lithium in Ionic Liquid/Organic Diluent Mixtures
-
Lane, G. H.; Best, A. S.; MacFarlane, D. R.; Forsyth, M.; Bayley, P. M.; Hollenkamp, A. F. The Electrochemistry of Lithium in Ionic Liquid/Organic Diluent Mixtures Electrochim. Acta 2010, 55, 8947-8952
-
(2010)
Electrochim. Acta
, vol.55
, pp. 8947-8952
-
-
Lane, G.H.1
Best, A.S.2
MacFarlane, D.R.3
Forsyth, M.4
Bayley, P.M.5
Hollenkamp, A.F.6
-
14
-
-
33846484932
-
Raman Study of Lithium Coordination in Emi-Tfsi Additive Systems as Lithium-Ion Battery Ionic Liquid Electrolytes
-
Hardwick, L. J.; Holzapfel, M.; Wokaun, A.; Novak, P. Raman Study of Lithium Coordination in Emi-Tfsi Additive Systems as Lithium-Ion Battery Ionic Liquid Electrolytes J. Raman Spectrosc. 2007, 38, 110-112
-
(2007)
J. Raman Spectrosc.
, vol.38
, pp. 110-112
-
-
Hardwick, L.J.1
Holzapfel, M.2
Wokaun, A.3
Novak, P.4
-
15
-
-
33748419469
-
Additive-Containing Ionic Liquid Electrolytes for Secondary Lithium Battery
-
Xu, J. Q.; Yang, J.; NuLi, Y.; Wang, J. L.; Zhang, Z. S. Additive-Containing Ionic Liquid Electrolytes for Secondary Lithium Battery J. Power Sources 2006, 160, 621-626
-
(2006)
J. Power Sources
, vol.160
, pp. 621-626
-
-
Xu, J.Q.1
Yang, J.2
Nuli, Y.3
Wang, J.L.4
Zhang, Z.S.5
-
16
-
-
40149095771
-
Effect of Organic Additives on the Cycling Performances of Lithium Metal Polymer Cells
-
Choi, J. A.; Eo, S. M.; MacFarlane, D. R.; Forsyth, M.; Cha, E.; Kim, D. W. Effect of Organic Additives on the Cycling Performances of Lithium Metal Polymer Cells J. Power Sources 2008, 178, 832-836
-
(2008)
J. Power Sources
, vol.178
, pp. 832-836
-
-
Choi, J.A.1
Eo, S.M.2
MacFarlane, D.R.3
Forsyth, M.4
Cha, E.5
Kim, D.W.6
-
17
-
-
0346780369
-
A Theoretical Study on the Anomalous Pressure Dependence of the Transport Properties of Ionic Liquids: Comparison among Lithium Bromide, Silica, and Water
-
Yamaguchi, T.; Nagao, A.; Matsuoka, T.; Koda, S. A Theoretical Study on the Anomalous Pressure Dependence of the Transport Properties of Ionic Liquids: Comparison Among Lithium Bromide, Silica, and Water J. Chem. Phys. 2003, 119, 11306-11317
-
(2003)
J. Chem. Phys.
, vol.119
, pp. 11306-11317
-
-
Yamaguchi, T.1
Nagao, A.2
Matsuoka, T.3
Koda, S.4
-
18
-
-
33748802228
-
+ Cation Environment, Transport, and Mechanical Properties of the Litfsi Doped N-Methyl-N-Alkylpyrrolidinium + Tfsi- Ionic Liquids
-
+ Cation Environment, Transport, and Mechanical Properties of the Litfsi Doped N-Methyl-N-Alkylpyrrolidinium + Tfsi- Ionic Liquids J. Phys. Chem. B 2006, 110, 16879-16886
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 16879-16886
-
-
Borodin, O.1
Smith, G.D.2
Henderson, W.3
-
19
-
-
34249314056
-
Effect of the Flexibility and the Anion in the Structural and Transport Properties of Ethyl-Methyl-Imidazolium Ionic Liquids
-
Rey-Castro, C.; Tormo, A. L.; Vega, L. F. Effect of the Flexibility and the Anion in the Structural and Transport Properties of Ethyl-Methyl-Imidazolium Ionic Liquids Fluid Phase Equilib. 2007, 256, 62-69
-
(2007)
Fluid Phase Equilib.
, vol.256
, pp. 62-69
-
-
Rey-Castro, C.1
Tormo, A.L.2
Vega, L.F.3
-
20
-
-
33644770604
-
Molecular Modeling and Experimental Studies of the Thermodynamic and Transport Properties of Pyridinium-Based Ionic Liquids
-
Cadena, C.; Zhao, Q.; Snurr, R. Q.; Maginn, E. J. Molecular Modeling and Experimental Studies of the Thermodynamic and Transport Properties of Pyridinium-Based Ionic Liquids J. Phys. Chem. B 2006, 110, 2821-2832
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 2821-2832
-
-
Cadena, C.1
Zhao, Q.2
Snurr, R.Q.3
Maginn, E.J.4
-
21
-
-
27744491174
-
A Theory of Transport Properties in Molten Salts
-
Koishi, T.; Tamaki, S. A Theory of Transport Properties in Molten Salts J. Chem. Phys. 2005, 123
-
(2005)
J. Chem. Phys.
, pp. 123
-
-
Koishi, T.1
Tamaki, S.2
-
22
-
-
78649880291
-
Structure and Dynamics of N,N-Diethyl-N-methylammonium Triflate Ionic Liquid, Neat and with Water, from Molecular Dynamics Simulations
-
Chang, T. M.; Dang, L. X.; Devanathan, R.; Dupuis, M. Structure and Dynamics of N,N-Diethyl-N-methylammonium Triflate Ionic Liquid, Neat and with Water, from Molecular Dynamics Simulations J. Phys. Chem. A 2010, 114, 12764-12774
-
(2010)
J. Phys. Chem. A
, vol.114
, pp. 12764-12774
-
-
Chang, T.M.1
Dang, L.X.2
Devanathan, R.3
Dupuis, M.4
-
23
-
-
84862235348
-
Synthesis of Imidazolium-Containing ABA Triblock Copolymers: Role of Charge Placement, Charge Density, and Ionic Liquid Incorporation
-
Green, M. D.; Choi, J. H.; Winey, K. I.; Long, T. E. Synthesis of Imidazolium-Containing ABA Triblock Copolymers: Role of Charge Placement, Charge Density, and Ionic Liquid Incorporation Macromolecules 2012, 45, 4749-4757
-
(2012)
Macromolecules
, vol.45
, pp. 4749-4757
-
-
Green, M.D.1
Choi, J.H.2
Winey, K.I.3
Long, T.E.4
-
24
-
-
0000141448
-
Self-Consistent Molecular Orbital Methods. 9. Extended Gaussian-Type Basis for Molecular-Orbital Studies of Organic Molecules
-
Ditchfield, R.; Hehre, W. J.; Pople, J. A. Self-Consistent Molecular Orbital Methods. 9. Extended Gaussian-Type Basis for Molecular-Orbital Studies of Organic Molecules J. Chem. Phys. 1971, 54, 724
-
(1971)
J. Chem. Phys.
, vol.54
, pp. 724
-
-
Ditchfield, R.1
Hehre, W.J.2
Pople, J.A.3
-
25
-
-
0347170005
-
Self-Consistent Molecular Orbital Methods. 12. Further Extensions of Gaussian-Type Basis Sets for Use in Molecular-Orbital Studies of Organic-Molecules
-
Hehre, W. J.; Ditchfield, R.; Pople, J. A. Self-Consistent Molecular Orbital Methods. 12. Further Extensions of Gaussian-Type Basis Sets for Use in Molecular-Orbital Studies of Organic-Molecules J. Chem. Phys. 1972, 56, 2257
-
(1972)
J. Chem. Phys.
, vol.56
, pp. 2257
-
-
Hehre, W.J.1
Ditchfield, R.2
Pople, J.A.3
-
26
-
-
33748545144
-
Influence of Polarization Functions on Molecular-Orbital Hydrogenation Energies
-
Hariharan, P. C.; Pople, J. A. Influence of Polarization Functions on Molecular-Orbital Hydrogenation Energies Theor. Chem. Acc. 1973, 28, 213
-
(1973)
Theor. Chem. Acc.
, vol.28
, pp. 213
-
-
Hariharan, P.C.1
Pople, J.A.2
-
27
-
-
85022583881
-
The Isomers of Silacyclopropane
-
Gordon, M. S. The Isomers of Silacyclopropane Chem. Phys. Lett. 1980, 76, 163-168
-
(1980)
Chem. Phys. Lett.
, vol.76
, pp. 163-168
-
-
Gordon, M.S.1
-
28
-
-
33645949559
-
Self-Consistent Molecular-Orbital Methods. 23. A Polarization-Type Basis Set for 2nd-Row Elements
-
Francl, M. M.; Pietro, W. J.; Hehre, W. J.; Binkley, J. S.; Gordon, M. S.; Defrees, D. J.; Pople, J. A. Self-Consistent Molecular-Orbital Methods. 23. A Polarization-Type Basis Set for 2nd-Row Elements J. Chem. Phys. 1982, 77, 3654-3665
-
(1982)
J. Chem. Phys.
, vol.77
, pp. 3654-3665
-
-
Francl, M.M.1
Pietro, W.J.2
Hehre, W.J.3
Binkley, J.S.4
Gordon, M.S.5
Defrees, D.J.6
Pople, J.A.7
-
29
-
-
84934460107
-
Compact Contracted Basis-Sets for 3rd-Row Atoms - Ga-Kr
-
Binning, R. C.; Curtiss, L. A. Compact Contracted Basis-Sets for 3rd-Row Atoms-Ga-Kr J. Comput. Chem. 1990, 11, 1206-1216
-
(1990)
J. Comput. Chem.
, vol.11
, pp. 1206-1216
-
-
Binning, R.C.1
Curtiss, L.A.2
-
30
-
-
0001689196
-
Extension of Gaussian-2 (G2) Theory to Molecules Containing Third-Row Atoms K and Ca
-
Blaudeau, J. P.; McGrath, M. P.; Curtiss, L. A.; Radom, L. Extension of Gaussian-2 (G2) Theory to Molecules Containing Third-Row Atoms K and Ca J. Chem. Phys. 1997, 107, 5016-5021
-
(1997)
J. Chem. Phys.
, vol.107
, pp. 5016-5021
-
-
Blaudeau, J.P.1
McGrath, M.P.2
Curtiss, L.A.3
Radom, L.4
-
31
-
-
0001508425
-
6-31G* Basis Set for Atoms K Through Zn
-
Rassolov, V. A.; Pople, J. A.; Ratner, M. A.; Windus, T. L. 6-31G* Basis Set for Atoms K Through Zn J. Chem. Phys. 1998, 109, 1223-1229
-
(1998)
J. Chem. Phys.
, vol.109
, pp. 1223-1229
-
-
Rassolov, V.A.1
Pople, J.A.2
Ratner, M.A.3
Windus, T.L.4
-
32
-
-
0002467378
-
Fast Parallel Algorithms for Short-Range Molecular-Dynamics
-
Plimpton, S. Fast Parallel Algorithms for Short-Range Molecular-Dynamics J. Comput. Phys. 1995, 117, 1-19
-
(1995)
J. Comput. Phys.
, vol.117
, pp. 1-19
-
-
Plimpton, S.1
-
33
-
-
0035953983
-
Perfluoroalkanes: Conformational Analysis and Liquid-State Properties from Ab Initio and Monte Carlo Calculations
-
Watkins, E. K.; Jorgensen, W. L. Perfluoroalkanes: Conformational Analysis and Liquid-State Properties from Ab Initio and Monte Carlo Calculations J. Phys. Chem. A 2001, 105, 4118-4125
-
(2001)
J. Phys. Chem. A
, vol.105
, pp. 4118-4125
-
-
Watkins, E.K.1
Jorgensen, W.L.2
-
34
-
-
36449003554
-
Constant-Pressure Molecular-Dynamics Algorithms
-
Martyna, G. J.; Tobias, D. J.; Klein, M. L. Constant-Pressure Molecular-Dynamics Algorithms J. Chem. Phys. 1994, 101, 4177-4189
-
(1994)
J. Chem. Phys.
, vol.101
, pp. 4177-4189
-
-
Martyna, G.J.1
Tobias, D.J.2
Klein, M.L.3
-
35
-
-
0019707626
-
Polymorphic Transitions in Single-Crystals - A New Molecular-Dynamics Method
-
Parrinello, M.; Rahman, A. Polymorphic Transitions in Single-Crystals-A New Molecular-Dynamics Method J. Appl. Phys. 1981, 52, 7182-7190
-
(1981)
J. Appl. Phys.
, vol.52
, pp. 7182-7190
-
-
Parrinello, M.1
Rahman, A.2
-
36
-
-
33646236900
-
A Liouville-Operator Derived. Measure-Preserving Integrator for Molecular Dynamics Simulations in the Isothermal-Isobaric Ensemble
-
Tuckerman, M. E.; Alejandre, J.; Lopez-Rendon, R.; Jochim, A. L.; Martyna, G. J. A Liouville-Operator Derived. Measure-Preserving Integrator for Molecular Dynamics Simulations in the Isothermal-Isobaric Ensemble J. Phys. A: Math. Gen. 2006, 39, 5629-5651
-
(2006)
J. Phys. A: Math. Gen.
, vol.39
, pp. 5629-5651
-
-
Tuckerman, M.E.1
Alejandre, J.2
Lopez-Rendon, R.3
Jochim, A.L.4
Martyna, G.J.5
-
37
-
-
42749105818
-
Rapid Estimation of Elastic Constants by Molecular Dynamics Simulation under Constant Stress
-
Shinoda, W.; Shiga, M.; Mikami, M. Rapid Estimation of Elastic Constants by Molecular Dynamics Simulation under Constant Stress Phys. Rev. B 2004, 69, 8
-
(2004)
Phys. Rev. B
, vol.69
, pp. 8
-
-
Shinoda, W.1
Shiga, M.2
Mikami, M.3
-
38
-
-
85024083583
-
A Molecular Dynamics Method for Simulations in the Canonical Ensemble
-
Nose, S. A Molecular Dynamics Method For Simulations in the Canonical Ensemble Mol. Phys. 2002, 100, 191-198
-
(2002)
Mol. Phys.
, vol.100
, pp. 191-198
-
-
Nose, S.1
-
39
-
-
84855241206
-
An Extension of the Canonical Ensemble Molecular-Dynamics Method
-
Nose, S. An Extension of the Canonical Ensemble Molecular-Dynamics Method Mol. Phys. 1986, 57, 187-191
-
(1986)
Mol. Phys.
, vol.57
, pp. 187-191
-
-
Nose, S.1
-
40
-
-
34547809547
-
A Unified Formulation of the Constant Temperature Molecular-Dynamics Methods
-
Nose, S. A Unified Formulation of the Constant Temperature Molecular-Dynamics Methods J. Chem. Phys. 1984, 81, 511-519
-
(1984)
J. Chem. Phys.
, vol.81
, pp. 511-519
-
-
Nose, S.1
-
41
-
-
84926811618
-
Constant Pressure Molecular-Dynamics for Molecular-Systems
-
Nose, S.; Klein, M. L. Constant Pressure Molecular-Dynamics for Molecular-Systems Mol. Phys. 1983, 50, 1055-1076
-
(1983)
Mol. Phys.
, vol.50
, pp. 1055-1076
-
-
Nose, S.1
Klein, M.L.2
-
42
-
-
0001538909
-
Canonical Dynamics - Equilibrium Phase-Space Distributions
-
Hoover, W. G. Canonical Dynamics-Equilibrium Phase-Space Distributions Phys. Rev. A 1985, 31, 1695-1697
-
(1985)
Phys. Rev. A
, vol.31
, pp. 1695-1697
-
-
Hoover, W.G.1
-
43
-
-
33846823909
-
Particle Mesh Ewald - An N.Log(N) Method for Ewald Sums in Large Systems
-
Darden, T.; York, D.; Pedersen, L. Particle Mesh Ewald-An N.Log(N) Method for Ewald Sums in Large Systems J. Chem. Phys. 1993, 98, 10089-10092
-
(1993)
J. Chem. Phys.
, vol.98
, pp. 10089-10092
-
-
Darden, T.1
York, D.2
Pedersen, L.3
-
44
-
-
0034506266
-
Efficient Particle-Mesh Ewald Based Approach to Fixed and Induced Dipolar Interactions
-
Toukmaji, A.; Sagui, C.; Board, J.; Darden, T. Efficient Particle-Mesh Ewald Based Approach to Fixed and Induced Dipolar Interactions J. Chem. Phys. 2000, 113, 10913-10927
-
(2000)
J. Chem. Phys.
, vol.113
, pp. 10913-10927
-
-
Toukmaji, A.1
Sagui, C.2
Board, J.3
Darden, T.4
-
45
-
-
0001222915
-
P3M3DP - The 3-Dimensional Periodic Particle-Particle-Particle-Mesh Program
-
Eastwood, J. W.; Hockney, R. W.; Lawrence, D. N. P3M3DP-The 3-Dimensional Periodic Particle-Particle-Particle-Mesh Program Comput. Phys. Commun. 1980, 19, 215-261
-
(1980)
Comput. Phys. Commun.
, vol.19
, pp. 215-261
-
-
Eastwood, J.W.1
Hockney, R.W.2
Lawrence, D.N.3
-
46
-
-
0001569292
-
Cutoff Errors in the Ewald Summation Formulas for Point-Charge Systems
-
Kolafa, J.; Perram, J. W. Cutoff Errors in the Ewald Summation Formulas For Point-Charge Systems Mol. Simul. 1992, 9, 351-368
-
(1992)
Mol. Simul.
, vol.9
, pp. 351-368
-
-
Kolafa, J.1
Perram, J.W.2
-
47
-
-
0000577932
-
Accuracy and Efficiency of the Particle Mesh Ewald Method
-
Petersen, H. G. Accuracy and Efficiency of the Particle Mesh Ewald Method J. Chem. Phys. 1995, 103, 3668-3679
-
(1995)
J. Chem. Phys.
, vol.103
, pp. 3668-3679
-
-
Petersen, H.G.1
-
48
-
-
0035828660
-
Estimate of the Cutoff Errors in the Ewald Summation for Dipolar Systems
-
Wang, Z. W.; Holm, C. Estimate of the Cutoff Errors in the Ewald Summation for Dipolar Systems J. Chem. Phys. 2001, 115, 6351-6359
-
(2001)
J. Chem. Phys.
, vol.115
, pp. 6351-6359
-
-
Wang, Z.W.1
Holm, C.2
-
49
-
-
0030172529
-
Comments on P(3)M, FMM, and the Ewald Method for Large Periodic Coulombic Systems
-
Pollock, E. L.; Glosli, J. Comments on P(3)M, FMM, and the Ewald Method for Large Periodic Coulombic Systems Comput. Phys. Commun. 1996, 95, 93-110
-
(1996)
Comput. Phys. Commun.
, vol.95
, pp. 93-110
-
-
Pollock, E.L.1
Glosli, J.2
-
50
-
-
84868686033
-
Development and Application of a Particle-Particle Particle-Mesh Ewald Method for Dispersion Interactions
-
Isele-Holder, R. E.; Mitchell, W.; Ismail, A. E. Development and Application of a Particle-Particle Particle-Mesh Ewald Method for Dispersion Interactions J. Chem. Phys. 2012, 137, 13
-
(2012)
J. Chem. Phys.
, vol.137
, pp. 13
-
-
Isele-Holder, R.E.1
Mitchell, W.2
Ismail, A.E.3
-
51
-
-
60649084560
-
Multilevel Summation of Electrostatic Potentials Using Graphics Processing Units
-
Hardy, D. J.; Stone, J. E.; Schulten, K. Multilevel Summation of Electrostatic Potentials Using Graphics Processing Units Parallel Comput. 2009, 35, 164-177
-
(2009)
Parallel Comput.
, vol.35
, pp. 164-177
-
-
Hardy, D.J.1
Stone, J.E.2
Schulten, K.3
-
54
-
-
84873560317
-
Ionic Conductivity and Transporting Properties in LiTFSI-Doped Bis(trifluoromethanesulfonyl)imide-Based Ionic Liquid Electrolyte
-
Wu, T. Y.; Hao, L.; Chen, P. R.; Liao, J. W. Ionic Conductivity and Transporting Properties in LiTFSI-Doped Bis(trifluoromethanesulfonyl)imide-Based Ionic Liquid Electrolyte Int. J. Electrochem. Sci. 2013, 8, 2606-2624
-
(2013)
Int. J. Electrochem. Sci.
, vol.8
, pp. 2606-2624
-
-
Wu, T.Y.1
Hao, L.2
Chen, P.R.3
Liao, J.W.4
-
55
-
-
79952471774
-
Transport Properties and Phase Behaviour in Binary and Ternary Ionic Liquid Electrolyte Systems of Interest in Lithium Batteries
-
Bayley, P. M.; Best, A. S.; MacFarlane, D. R.; Forsyth, M. Transport Properties and Phase Behaviour in Binary and Ternary Ionic Liquid Electrolyte Systems of Interest in Lithium Batteries ChemPhysChem 2011, 12, 823-827
-
(2011)
ChemPhysChem
, vol.12
, pp. 823-827
-
-
Bayley, P.M.1
Best, A.S.2
MacFarlane, D.R.3
Forsyth, M.4
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