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Bdsk-Url-1 = {http://gateway.isiknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcAuth=Alerting&SrcApp=Alerting&DestApp=WOS&DestLinkType=FullRecord;KeyUT=000226558200006}} |
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@article{ISI:000080382700030, |
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Abstract = {{A nonequilibrium method for calculating the shear viscosity is |
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> |
Abstract = {A nonequilibrium method for calculating the shear viscosity is |
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presented. It reverses the cause-and-effect picture customarily used in |
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nonequilibrium molecular dynamics: the effect, the momentum flux or |
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stress, is imposed, whereas the cause, the velocity gradient or shear |
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property. The method is tested on the Lennard-Jones fluid near its |
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triple point. It yields a viscosity of 3.2-3.3, in Lennard-Jones |
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reduced units, in agreement with literature results. |
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< |
{[}S1063-651X(99)03105-0].}}, |
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< |
Address = {{ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA}}, |
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Affiliation = {{Muller-Plathe, F (Reprint Author), Max Planck Inst Polymerforsch, Ackermannweg 10, D-55128 Mainz, Germany. Max Planck Inst Polymerforsch, D-55128 Mainz, Germany.}}, |
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{[}S1063-651X(99)03105-0].}, |
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> |
Address = {ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA}, |
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> |
Affiliation = {Muller-Plathe, F (Reprint Author), Max Planck Inst Polymerforsch, Ackermannweg 10, D-55128 Mainz, Germany. Max Planck Inst Polymerforsch, D-55128 Mainz, Germany.}, |
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Author = {Muller-Plathe, F}, |
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Date-Added = {2009-10-01 14:07:30 -0400}, |
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Date-Modified = {2009-10-01 14:07:30 -0400}, |
286 |
< |
Doc-Delivery-Number = {{197TX}}, |
287 |
< |
Issn = {{1063-651X}}, |
288 |
< |
Journal = {{PHYSICAL REVIEW E}}, |
289 |
< |
Journal-Iso = {{Phys. Rev. E}}, |
290 |
< |
Language = {{English}}, |
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< |
Month = {{MAY}}, |
292 |
< |
Number = {{5, Part A}}, |
293 |
< |
Number-Of-Cited-References = {{17}}, |
294 |
< |
Pages = {{4894-4898}}, |
295 |
< |
Publisher = {{AMERICAN PHYSICAL SOC}}, |
296 |
< |
Subject-Category = {{Physics, Fluids \& Plasmas; Physics, Mathematical}}, |
297 |
< |
Times-Cited = {{57}}, |
298 |
< |
Title = {{Reversing the perturbation in nonequilibrium molecular dynamics: An easy way to calculate the shear viscosity of fluids}}, |
299 |
< |
Type = {{Article}}, |
300 |
< |
Unique-Id = {{ISI:000080382700030}}, |
301 |
< |
Volume = {{59}}, |
302 |
< |
Year = {{1999}}} |
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> |
Doc-Delivery-Number = {197TX}, |
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> |
Issn = {1063-651X}, |
288 |
> |
Journal = {PHYSICAL REVIEW E}, |
289 |
> |
Journal-Iso = {Phys. Rev. E}, |
290 |
> |
Language = {English}, |
291 |
> |
Month = {MAY}, |
292 |
> |
Number = {5, Part A}, |
293 |
> |
Number-Of-Cited-References = {17}, |
294 |
> |
Pages = {4894-4898}, |
295 |
> |
Publisher = {AMERICAN PHYSICAL SOC}, |
296 |
> |
Subject-Category = {Physics, Fluids \& Plasmas; Physics, Mathematical}, |
297 |
> |
Times-Cited = {57}, |
298 |
> |
Title = {Reversing the perturbation in nonequilibrium molecular dynamics: An easy way to calculate the shear viscosity of fluids}, |
299 |
> |
Type = {Article}, |
300 |
> |
Unique-Id = {ISI:000080382700030}, |
301 |
> |
Volume = {59}, |
302 |
> |
Year = {1999}} |
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|
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@article{ISI:000246190100032, |
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< |
Abstract = {{Atomistic simulations are conducted to examine the dependence of the |
305 |
> |
Abstract = {Atomistic simulations are conducted to examine the dependence of the |
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viscosity of 1-ethyl-3-methylimidazolium |
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bis(trifluoromethanesulfonyl)imide on temperature and water content. A |
308 |
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nonequilibrium molecular dynamics procedure is utilized along with an |
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The use of a nonequilibrium simulation technique enables diffusive |
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behavior to be observed on the time scale of the simulations, and |
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standard equilibrium molecular dynamics resulted in sub-diffusive |
324 |
< |
behavior even over 2 ns of simulation time.}}, |
325 |
< |
Address = {{1155 16TH ST, NW, WASHINGTON, DC 20036 USA}}, |
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< |
Affiliation = {{Maginn, EJ (Reprint Author), Univ Notre Dame, Dept Chem \& Biomol Engn, 182 Fitzpatrick Hall, Notre Dame, IN 46556 USA. Univ Notre Dame, Dept Chem \& Biomol Engn, Notre Dame, IN 46556 USA.}}, |
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> |
behavior even over 2 ns of simulation time.}, |
325 |
> |
Address = {1155 16TH ST, NW, WASHINGTON, DC 20036 USA}, |
326 |
> |
Affiliation = {Maginn, EJ (Reprint Author), Univ Notre Dame, Dept Chem \& Biomol Engn, 182 Fitzpatrick Hall, Notre Dame, IN 46556 USA. Univ Notre Dame, Dept Chem \& Biomol Engn, Notre Dame, IN 46556 USA.}, |
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Author = {Kelkar, Manish S. and Maginn, Edward J.}, |
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< |
Author-Email = {{ed@nd.edu}}, |
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> |
Author-Email = {ed@nd.edu}, |
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|
Date-Added = {2009-09-29 17:07:17 -0400}, |
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Date-Modified = {2009-09-29 17:07:17 -0400}, |
331 |
< |
Doc-Delivery-Number = {{163VA}}, |
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< |
Doi = {{10.1021/jp0686893}}, |
333 |
< |
Issn = {{1520-6106}}, |
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< |
Journal = {{JOURNAL OF PHYSICAL CHEMISTRY B}}, |
335 |
< |
Journal-Iso = {{J. Phys. Chem. B}}, |
336 |
< |
Keywords-Plus = {{MOLECULAR-DYNAMICS SIMULATION; MOMENTUM IMPULSE RELAXATION; FORCE-FIELD; TRANSPORT-PROPERTIES; PHYSICAL-PROPERTIES; SIMPLE FLUID; CHLORIDE; MODEL; SALTS; ARCHITECTURE}}, |
337 |
< |
Language = {{English}}, |
338 |
< |
Month = {{MAY 10}}, |
339 |
< |
Number = {{18}}, |
340 |
< |
Number-Of-Cited-References = {{57}}, |
341 |
< |
Pages = {{4867-4876}}, |
342 |
< |
Publisher = {{AMER CHEMICAL SOC}}, |
343 |
< |
Subject-Category = {{Chemistry, Physical}}, |
344 |
< |
Times-Cited = {{35}}, |
345 |
< |
Title = {{Effect of temperature and water content on the shear viscosity of the ionic liquid 1-ethyl-3-methylimidazolium bis(trifluoromethanesulfonyl)imide as studied by atomistic simulations}}, |
346 |
< |
Type = {{Article}}, |
347 |
< |
Unique-Id = {{ISI:000246190100032}}, |
348 |
< |
Volume = {{111}}, |
349 |
< |
Year = {{2007}}, |
331 |
> |
Doc-Delivery-Number = {163VA}, |
332 |
> |
Doi = {10.1021/jp0686893}, |
333 |
> |
Issn = {1520-6106}, |
334 |
> |
Journal = {JOURNAL OF PHYSICAL CHEMISTRY B}, |
335 |
> |
Journal-Iso = {J. Phys. Chem. B}, |
336 |
> |
Keywords-Plus = {MOLECULAR-DYNAMICS SIMULATION; MOMENTUM IMPULSE RELAXATION; FORCE-FIELD; TRANSPORT-PROPERTIES; PHYSICAL-PROPERTIES; SIMPLE FLUID; CHLORIDE; MODEL; SALTS; ARCHITECTURE}, |
337 |
> |
Language = {English}, |
338 |
> |
Month = {MAY 10}, |
339 |
> |
Number = {18}, |
340 |
> |
Number-Of-Cited-References = {57}, |
341 |
> |
Pages = {4867-4876}, |
342 |
> |
Publisher = {AMER CHEMICAL SOC}, |
343 |
> |
Subject-Category = {Chemistry, Physical}, |
344 |
> |
Times-Cited = {35}, |
345 |
> |
Title = {Effect of temperature and water content on the shear viscosity of the ionic liquid 1-ethyl-3-methylimidazolium bis(trifluoromethanesulfonyl)imide as studied by atomistic simulations}, |
346 |
> |
Type = {Article}, |
347 |
> |
Unique-Id = {ISI:000246190100032}, |
348 |
> |
Volume = {111}, |
349 |
> |
Year = {2007}, |
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|
Bdsk-Url-1 = {http://dx.doi.org/10.1021/jp0686893%7D}} |
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@article{MullerPlathe:1997xw, |