Drifting mass accommodation coefficients: in situ measurements from a steady state molecular dynamics setup

References

• S. Chapman, T. G. Cowling, and D. Burnett, The Mathematical Theory of Non-uniform Gases: An Account of the Kinetic Theory of Viscosity, Thermal Conduction and Diffusion in Gases. Cambridge University Press, 1990.
   Google Scholar
• V. P. Carey, Liquid Vapor Phase Change Phenomena: An Introduction to the Thermophysics of Vaporization and Condensation Processes in Heat Transfer Equipment. CRC Press, 2018.
   Google Scholar
• A. P. Kryukov and V. Y. Levashov, “About evaporation–condensation coefficients on the vapor–liquid interface of high thermal conductivity matters,” Int. J. Heat Mass Tran., vol. 54, no. 13–14, pp.3042–3048, 2011. DOI: 10.1016/j.ijheatmasstransfer.2011.02.042.
   Web of Science ®Google Scholar
• R. Marek and J. Straub, “Analysis of the evaporation coefficient and the condensation coefficient of water,” Int. J. Heat Mass Tran., vol. 44, no. 1, pp.39–53, 2001. DOI: 10.1016/S0017-9310(00)00086-7.
   Web of Science ®Google Scholar
• A. H. Persad and C. A. Ward, “Expressions for the evaporation and condensation coefficients in the hertz-knudsen relation,” Chem. Rev., vol. 116, no. 14, pp.7727–7767, 2016. DOI: 10.1021/acs.chemrev.5b00511.
   PubMed Web of Science ®Google Scholar
• H. Hertz, “Ueber die verdunstung der flüssigkeiten, insbesondere des quecksilbers, im luftleeren raume,” Ann. Phys., vol. 253, pp. 177–193, 1882. DOI: 10.1002/andp.18822531002.
   Google Scholar
• R. W. Schrage. A theoretical study of interphase mass transfer. PhD thesis, Columbia University Press, 1953.
   Google Scholar
• G. Standart and Z. Cihla, “Interphase transport processes. i. schrage’s theories,” Collect. Czech Chem. C, vol. 23, no. 9, pp.1608–1618, 1958. DOI: 10.1135/cccc19581608.
   Google Scholar
• K. Yasuoka and M. Matsumoto, “Evaporation and condensation at a liquid surface. i. argon,” J. Chem. Phys, vol. 101, no. 9, pp.7904–7911, 1994. DOI: 10.1063/1.468216.
   Web of Science ®Google Scholar
• M. Matsumoto and K. Yasuoka, “Evaporation and condensation at a liquid surface. ii. methanol,” J. Chem. Phys., vol. 101, no. 9, pp.7912–7917, 1994. DOI: 10.1063/1.468217.
   Web of Science ®Google Scholar
• G. Nagayama and T. Tsuruta, “A general expression for the condensation coefficient based on the transition state theory and molecular dynamics simulation,” J. Chem. Phys., vol. 118, no. 3, pp.1392–1399, 2003. DOI: 10.1063/1.1528192.
   Web of Science ®Google Scholar
• R. Meland, A. Frezzotti, T. Ytrehus, and B. Hafskjold, “Nonequilibrium molecular-dynamics simulation of net evaporation and net condensation, and evaluation of the gas-kinetic boundary condition at the interphase,” Phys. Fluids, vol. 16, no. 2, pp.223–243, 2004. DOI: 10.1063/1.1630797.
   Web of Science ®Google Scholar
• S. H. Algie, “Kinetic theories of evaporation,” J. Chem. Phys., vol. 69, no. 2, pp.538–543, 1978. DOI: 10.1063/1.436644.
   Web of Science ®Google Scholar
• I. W. Eames, N. J. Marr, and H. Sabir, “The evaporation coefficient of water: a review,” Int. J. Heat Mass Tran., vol. 40, pp. 2963–2973, 1997. DOI: 10.1016/S0017-9310(96)00339-0.
   Web of Science ®Google Scholar
• M. Knudsen, “Maximum rate of vaporization of mercury,” Ann. Phys., vol. 47, pp. 697–705, 1915. DOI: 10.1002/andp.19153521306.
   Google Scholar
• T. K. Xia and U. Landman, “Molecular evaporation and condensation of liquid n-alkane films,” J. Chem. Phys., vol. 101, no. 3, pp.2498–2507, 1994. DOI: 10.1063/1.467689.
   Web of Science ®Google Scholar
• M. Matsumoto, “Molecular dynamics of fluid phase change,” Fluid Phase Equilib, vol. 144, no. 1–2, pp.307–314, 1998. DOI: 10.1016/S0378-3812(97)00274-4.
   Web of Science ®Google Scholar
• S. I. Anisimov, D. O. Dunikov, V. V. Zhakhovskii, and S. P. Malyshenko, “Properties of a liquid–gas interface at high-rate evaporation,” J. Chem. Phys., vol. 110, no. 17, pp.8722–8729, 1999. DOI: 10.1063/1.478779.
   Web of Science ®Google Scholar
• R. Hołyst, M. Litniewski, and D. Jakubczyk, “A molecular dynamics test of the hertz–knudsen equation for evaporating liquids,” Soft Matter, vol. 11, pp. 7201–7206, 2015. DOI: 10.1039/C5SM01508A.
   PubMed Web of Science ®Google Scholar
• J. Barrett and C. Clement, “Kinetic evaporation and condensation rates and their coefficients,” J. Colloid Interf. Sci., vol. 150, no. 2, pp.352–364, 1992. DOI: 10.1016/0021-9797(92)90205-Z.
   Web of Science ®Google Scholar
• T. Tsuruta and G. Nagayama, “A microscopic formulation of condensation coefficient and interface transport phenomena,” Energy, vol. 30, no. 6, pp.795–805, 2005. DOI: 10.1016/j.energy.2004.04.011.
   Web of Science ®Google Scholar
• S. Cheng, J. B. Lechman, S. J. Plimpton, and G. S. Grest, “Evaporation of lennard-jones fluids,” J. Chem. Phys., vol. 134, pp. 224704, 2011. DOI: 10.1063/1.3595260.
   PubMed Web of Science ®Google Scholar
• K. Yasuoka, M. Matsumoto, and Y. Kataoka, “Dynamics near a liquid surface: mechanisms of evaporation and condensation,” J. Mol. Liq., vol. 65–66, pp. 329–332, 1995. DOI: 10.1016/0167-7322(95)00892-0.
   Web of Science ®Google Scholar
• T. Tsuruta, H. Tanaka, and T. Masuoka, “Condensation/evaporation coefficient and velocity distributions at liquid–vapor interface,” Int. J. Heat Mass Tran., vol. 42, no. 22, pp.4107–4116, 1999. DOI: 10.1016/S0017-9310(99)00081-2.
   Web of Science ®Google Scholar
• A. Røsjorde, S. Kjelstrup, D. Bedeaux, and B. Hafskjold, “Nonequilibrium molecular dynamics simulations of steady-state heat and mass transport in condensation. ii. transfer coefficients,” J. Colloid Interf. Sci., vol. 240, no. 1, pp.355–364, 2001. DOI: 10.1006/jcis.2001.7611.
   PubMed Web of Science ®Google Scholar
• T. Tsuruta and G. Nagayama, “Molecular dynamics studies on the condensation coefficient of water,” J. Phys. Chem. B, vol. 108, no. 5, pp.1736–1743, 2004. DOI: 10.1021/jp035885q.
   Web of Science ®Google Scholar
• Z. Liang, T. Biben, and P. Keblinski, “Molecular simulation of steady-state evaporation and condensation: validity of the schrage relationships,” Int. J. Heat Mass Tran., vol. 114, pp. 105–114, 2017. DOI: 10.1016/j.ijheatmasstransfer.2017.06.025.
   Web of Science ®Google Scholar
• D. Fuster, G. Hauke, and C. Dopazo, “Influence of the accommodation coefficient on nonlinear bubble oscillations,” J. Acoust. Soc. Am., vol. 128, no. 1, pp.5–10, 2010. DOI: 10.1121/1.3436520.
   PubMed Web of Science ®Google Scholar
• P. C. Wayner, Y. K. Kao, and L. V. LaCroix, “The interline heat-transfer coefficient of an evaporating wetting film,” Int. J. Heat Mass Tran., vol. 19, pp. 487–492, 1976. DOI: 10.1016/0017-9310(76)90161-7.
   Web of Science ®Google Scholar
• G. T. Barnes, “The effects of monolayers on the evaporation of liquids,” Adv. Colloid Interfac., vol. 25, pp. 89–200, 1986. DOI: 10.1016/0001-8686(86)80004-5.
   Web of Science ®Google Scholar
• P. C. Wayner, “The effect of interfacial mass transport on flow in thin liquid films,” Colloid. Surf., vol. 52, pp. 71–84, 1991. DOI: 10.1016/0166-6622(91)80006-A.
   Google Scholar
• P. C. Wayner, “Intermolecular forces in phase-change heat transfer: 1998 kern award review,” AIChE J., vol. 45, no. 10, pp.2055–2068, 1999. DOI: 10.1002/aic.690451004.
   Web of Science ®Google Scholar
• J. L. Plawsky, M. Ojha, A. Chatterjee, and P. C. Wayner, “Review of the effects of surface topography, surface chemistry, and fluid physics on evaporation at the contact line,” Chem. Eng. Commun., vol. 196, no. 5, pp.658–696, 2008. DOI: 10.1080/00986440802569679.
   Web of Science ®Google Scholar
• R. Hołyst, M. Litniewski, D. Jakubczyk, M. Zientara, and M. Woźniak, “Nanoscale transport of energy and mass flux during evaporation of liquid droplets into inert gas: computer simulations and experiments,” Soft Matter, vol. 9, no. 32, pp.7766–7774, 2013. DOI: 10.1039/c3sm50997d.
   Web of Science ®Google Scholar
• K. H. Do, S. J. Kim, and S. V. Garimella, “A mathematical model for analyzing the thermal characteristics of a flat micro heat pipe with a grooved wick,” Int. J. Heat Mass Tran., vol. 51, pp. 4637–4650, 2008. DOI: 10.1016/j.ijheatmasstransfer.2008.02.039.
   Web of Science ®Google Scholar
• S. Du and Y. H. Zhao, “New boundary conditions for the evaporating thin-film model in a rectangular micro channel,” Int. J. Heat Mass Tran., vol. 54, pp. 3694–3701, 2011. DOI: 10.1016/j.ijheatmasstransfer.2011.02.059.
   Web of Science ®Google Scholar
• Y. Akkuş, H. I. Tarman, B. Çetin, and Z. Dursunkaya, “Two-dimensional computational modeling of thin film evaporation,” Int. J. Therm. Sci., vol. 121, pp. 237–248, 2017. DOI: 10.1016/j.ijthermalsci.2017.07.013.
   Web of Science ®Google Scholar
• M. Alipour and Z. Dursunkaya, “Limitations of matching condensing film profile on a micro fin with the groove: critical effect of disjoining pressure,” Nanosc. Microsc. Therm., vol. 23, no. 4, pp.289–303, 2019. DOI: 10.1080/15567265.2019.1633712.
   Web of Science ®Google Scholar
• O. Akdag, Y. Akkus, and Z. Dursunkaya, “On the effect of structural forces on a condensing film profile near a fin-groove corner,” Int. Commun. Heat. Mass., vol. 116, pp. 104686, 2020. DOI: 10.1016/j.icheatmasstransfer.2020.104686.
   Web of Science ®Google Scholar
• G. Fang and C. A. Ward, “Temperature measured close to the interface of an evaporating liquid,” Phys. Rev. E, vol. 59, no. 1, pp.417, 1999. DOI: 10.1103/PhysRevE.59.417.
   Web of Science ®Google Scholar
• C. A. Ward and D. Stanga, “Interfacial conditions during evaporation or condensation of water,” Phys. Rev. E, vol. 64, no. 5, pp.051509, 2001. DOI: 10.1103/PhysRevE.64.051509.
   Web of Science ®Google Scholar
• E. J. Davis, “A history and state-of-the-art of accommodation coefficients,” Atmos. Res., vol. 82, no. 3–4, pp.561–578, 2006. DOI: 10.1016/j.atmosres.2006.02.013.
   Web of Science ®Google Scholar
• K. Bellur, E. F. Médici, C. K. Choi, J. C. Hermanson, and J. S. Allen, “Multiscale approach to model steady meniscus evaporation in a wetting fluid,” Phys. Rev. Fluids, vol. 5, no. 2, pp.024001, 2020. DOI: 10.1103/PhysRevFluids.5.024001.
   Web of Science ®Google Scholar
• T. Ishiyama, T. Yano, and S. Fujikawa, “Molecular dynamics study of kinetic boundary condition at an interface between argon vapor and its condensed phase,” Phys. Fluids, vol. 16, no. 8, pp.2899–2906, 2004. DOI: 10.1063/1.1763936.
   Web of Science ®Google Scholar
• R. Hołyst and M. Litniewski, “Evaporation into vacuum: mass flux from momentum flux and the hertz–knudsen relation revisited,” J. Chem. Phys., vol. 130, no. 7, pp.074707, 2009. DOI: 10.1063/1.3077059.
   PubMed Web of Science ®Google Scholar
• G. Nagayama, M. Takematsu, H. Mizuguchi, and T. Tsuruta, “Molecular dynamics study on condensation/evaporation coefficients of chain molecules at liquid–vapor interface,” J. Chem. Phys., vol. 143, pp. 014706, 2015. DOI: 10.1063/1.4923261.
   PubMed Web of Science ®Google Scholar
• T. Tsuruta, N. Sakamoto, and T. Masuoka, “Condensation process at liquid-vapor interface and condensation coefficient,” Therm. Sci. Eng., vol. 3, pp. 85–90, 1995.
   Google Scholar
• M. Matsumoto and Y. Kataoka, “Dynamic processes at a liquid surface of methanol,” Phys. Rev. Lett., vol. 69, no. 26, pp.3782, 1992. DOI: 10.1103/PhysRevLett.69.3782.
   PubMed Web of Science ®Google Scholar
• J. Yu and H. Wang, “A molecular dynamics investigation on evaporation of thin liquid films,” Int. J. Heat Mass Tran., vol. 55, no. 4, pp.1218–1225, 2012. DOI: 10.1016/j.ijheatmasstransfer.2011.09.035.
   Web of Science ®Google Scholar
• Z. Liang and P. Keblinski, “Molecular simulation of steady-state evaporation and condensation in the presence of a non-condensable gas,” J. Chem. Phys., vol. 148, pp. 064708, 2018. DOI: 10.1063/1.5020095.
   PubMed Web of Science ®Google Scholar
• B. Hafskjold and S. K. Ratkje, “Criteria for local equilibrium in a system with transport of heat and mass,” J. Stat. Phys., vol. 78, no. 1–2, pp.463–494, 1995. DOI: 10.1007/BF02183360.
   Web of Science ®Google Scholar
• Y. Akkus and A. Beskok, “Molecular diffusion replaces capillary pumping in phase-change-driven nanopumps,” Microfluid. Nanofluid., vol. 23, no. 2, pp.14, 2019. DOI: 10.1007/s10404-018-2185-7.
   Web of Science ®Google Scholar
• Y. Akkus, A. Koklu, and A. Beskok, “Atomic scale interfacial transport at an extended evaporating meniscus,” Langmuir, vol. 35, no. 13, pp.4491–4497, 2019. DOI: 10.1021/acs.langmuir.8b04219.
   PubMed Web of Science ®Google Scholar
• Y. Akkus, C. T. Nguyen, A. T. Celebi, and A. Beskok, “A first look at the performance of nano-grooved heat pipes,” Int. J. Heat Mass Tran., vol. 132, pp. 280–287, 2019. DOI: 10.1016/j.ijheatmasstransfer.2018.12.022.
   Web of Science ®Google Scholar
• Y. Akkuş, “Modeling of evaporation from nanoporous membranes using molecular dynamics simulation,” Isi Bilim Tek. Derg., vol. 39, pp. 91–99, 2019.
   Web of Science ®Google Scholar
• F. Heslot, N. Fraysse, and A. M. Cazabat, “Molecular layering in the spreading of wetting liquid drops,” Nature, vol. 338, no. 6217, pp.640, 1989. DOI: 10.1038/338640a0.
   Web of Science ®Google Scholar
• L. Cheng, P. Fenter, K. L. Nagy, M. L. Schlegel, and N. C. Sturchio, “Molecular-scale density oscillations in water adjacent to a mica surface,” Phys. Rev. Lett., vol. 87, pp. 156103, 2001. DOI: 10.1103/PhysRevLett.87.156103.
   PubMed Web of Science ®Google Scholar
• S. Yesudasan and S. C. Maroo, “Origin of surface-driven passive liquid flows,” Langmuir, vol. 32, no. 34, pp.8593–8597, 2016. DOI: 10.1021/acs.langmuir.6b02117.
   PubMed Web of Science ®Google Scholar
• J. R. D. Copley and S. W. Lovesey, “The dynamic properties of monatomic liquids,” Rep. Prog. Phys., vol. 38, no. 4, pp.461, 1975. DOI: 10.1088/0034-4885/38/4/001.
   Web of Science ®Google Scholar
• T. Q. Vo, M. Barisik, and B. H. Kim, “Near-surface viscosity effects on capillary rise of water in nanotubes,” Phys. Rev. E, vol. 92, no. 5, pp.053009, 2015. DOI: 10.1103/PhysRevE.92.053009.
   PubMed Web of Science ®Google Scholar
• Y. Pao, “Application of kinetic theory to the problem of evaporation and condensation,” Phys. Fluids, vol. 14, no. 2, pp.306–312, 1971. DOI: 10.1063/1.1693429.
   Web of Science ®Google Scholar
• A. Frezzotti, P. Grosfils, and S. Toxvaerd, “Evidence of an inverted temperature gradient during evaporation/condensation of a lennard-jones fluid,” Phys. Fluids, vol. 15, no. 10, pp.2837–2842, 2003. DOI: 10.1063/1.1601221.
   Web of Science ®Google Scholar
• T. Ytrehus, “Molecular-flow effects in evaporation and condensation at interfaces,” Multiphase Sci. Technol., vol. 9, no. 3, 1997. DOI: 10.1615/MultScienTechn.v9.i3.10.
   Google Scholar
• K. Bellur. A New Technique to Determine Accommodation Coefficients of Cryogenic Propellants. PhD thesis, 2018.
   Google Scholar