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Volumn 67, Issue 12, 2011, Pages 2130-2140

A study on the measurement of mean velocity and its convergence in molecular dynamics simulations

Author keywords

Molecular dynamics; Numerical simulation; Periodic boundary condition; Sampling and averaging; Solution convergence; Velocity measurement

Indexed keywords

AVERAGE VALUES; AVERAGING METHOD; CHAOTIC NATURE; CONVERGENCE CRITERION; LOCAL MEAN; MACROSCOPIC QUANTITIES; MEAN FLOW VELOCITIES; MEAN VELOCITIES; MICROSCOPIC BEHAVIOR; MOLECULAR DYNAMICS SIMULATIONS; PARTICLE-BASED SIMULATION; PERIODIC BOUNDARY CONDITIONS; RANDOM PATHS; RELIABLE PERFORMANCE; SPECIFIC PROBLEMS; STATISTICAL ERRORS; TEMPORAL BEHAVIOR; TEST CASE;

EID: 83255187977     PISSN: 02712091     EISSN: 10970363     Source Type: Journal    
DOI: 10.1002/fld.2487     Document Type: Article
Times cited : (9)

References (13)
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    • Liquid flow in surface-nanostructured channels studied by molecular dynamics simulation
    • Cao B-Y, Chen M, Guo Z-Y. Liquid flow in surface-nanostructured channels studied by molecular dynamics simulation. Physical Review E 2006; 74:6311.
    • (2006) Physical Review E , vol.74 , pp. 6311
    • Cao, B.-Y.1    Chen, M.2    Guo, Z.-Y.3
  • 4
    • 1942475413 scopus 로고    scopus 로고
    • Measurement bias of fluid velocity in molecular simulations
    • Tysanner MW, Garcia AL. Measurement bias of fluid velocity in molecular simulations. Journal of Computational Physics 2004; 196:173-183.
    • (2004) Journal of Computational Physics , vol.196 , pp. 173-183
    • Tysanner, M.W.1    Garcia, A.L.2
  • 5
    • 0000628431 scopus 로고    scopus 로고
    • Application of a multiple time step algorithm to biomolecular systems
    • Cheng A, Merz KM. Application of a multiple time step algorithm to biomolecular systems. Journal of Physical Chemistry B 1999; 103(25):5396-5405.
    • (1999) Journal of Physical Chemistry B , vol.103 , Issue.25 , pp. 5396-5405
    • Cheng, A.1    Merz, K.M.2
  • 7
  • 8
  • 9
    • 83255166143 scopus 로고    scopus 로고
    • Bin size determination for the measurement of mean flow velocity in molecular dynamics simulations. Second European Conference on Microfluidics, Toulouse, France, December 2010.
    • Karimian SMH, Izadi S. Bin size determination for the measurement of mean flow velocity in molecular dynamics simulations. Second European Conference on Microfluidics, Toulouse, France, December 2010.
    • Karimian, S.M.H.1    Izadi, S.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.