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Molecular Simulation Volume 32, 2006 - Issue 3-4: SPECIAL ISSUE: FRONTIERS OF MOLECULAR SIMULATION
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Original Articles

Multi-paradigm multi-scale simulations for fuel cell catalysts and membranes

W. Goddard III Beckman Institute (139-74), California Institute of Technology, Materials and Process Simulation Center, Division of Chemistry and Chemical Engineering, Pasadena, CA, 91125, USACorrespondence[email protected]
,
B. Merinov Beckman Institute (139-74), California Institute of Technology, Materials and Process Simulation Center, Division of Chemistry and Chemical Engineering, Pasadena, CA, 91125, USA
,
A. van Duin Beckman Institute (139-74), California Institute of Technology, Materials and Process Simulation Center, Division of Chemistry and Chemical Engineering, Pasadena, CA, 91125, USA
,
T. Jacob Beckman Institute (139-74), California Institute of Technology, Materials and Process Simulation Center, Division of Chemistry and Chemical Engineering, Pasadena, CA, 91125, USA
,
M. Blanco Beckman Institute (139-74), California Institute of Technology, Materials and Process Simulation Center, Division of Chemistry and Chemical Engineering, Pasadena, CA, 91125, USA
,
V. Molinero Beckman Institute (139-74), California Institute of Technology, Materials and Process Simulation Center, Division of Chemistry and Chemical Engineering, Pasadena, CA, 91125, USA
,
S.S. Jang Beckman Institute (139-74), California Institute of Technology, Materials and Process Simulation Center, Division of Chemistry and Chemical Engineering, Pasadena, CA, 91125, USA
&
Y.H. Jang Beckman Institute (139-74), California Institute of Technology, Materials and Process Simulation Center, Division of Chemistry and Chemical Engineering, Pasadena, CA, 91125, USA
 show all
Pages 251-268 | Received 01 Dec 2005, Accepted 01 Jan 2006, Published online: 31 Jan 2007

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Tran Thi Bao Le, Alberto Striolo & David R. Cole. (2018) Structural and dynamical properties predicted by reactive force fields simulations for four common pure fluids at liquid and gaseous non-reactive conditions. Molecular Simulation 44:10, pages 826-839.
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N. Djilali & P.C. Sui. (2008) Transport phenomena in fuel cells: from microscale to macroscale. International Journal of Computational Fluid Dynamics 22:1-2, pages 115-133.
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