메뉴 건너뛰기




Volumn 133, Issue 23, 2010, Pages

Widom line and the liquid-liquid critical point for the TIP4P/2005 water model

Author keywords

[No Author keywords available]

Indexed keywords

CRITICAL PARAMETER; CRITICAL TEMPERATURES; HOMOGENEOUS NUCLEATION; LIQUID-LIQUID CRITICAL POINT; MAXIMUM DENSITY; SUPERCOOLED REGIONS; WATER MODELS;

EID: 78650713175     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3506860     Document Type: Article
Times cited : (316)

References (112)
  • 4
    • 0037068432 scopus 로고    scopus 로고
    • Radionuclide contamination: Nanometre-size products of uranium bioreduction
    • DOI 10.1038/419134a
    • O. Mishima and Y. Suzuki, Nature 419, 599 (2002). 10.1038/419134a (Pubitemid 35025437)
    • (2002) Nature , vol.419 , Issue.6903 , pp. 134
    • Suzuki, Y.1    Kelly, S.D.2    Kemner, K.M.3    Banfield, J.F.4
  • 7
    • 0032569809 scopus 로고    scopus 로고
    • The relationship between liquid, supercooled and glassy water
    • DOI 10.1038/24540
    • O. Mishima and H. E. Stanley, Nature 396, 329 (1998). 10.1038/24540 (Pubitemid 28557386)
    • (1998) Nature , vol.396 , Issue.6709 , pp. 329-335
    • Mishima, O.1    Stanley, H.E.2
  • 8
    • 0032510536 scopus 로고    scopus 로고
    • Decompression-induced melting of ice IV and the liquid-liquid transition in water
    • DOI 10.1038/32386
    • O. Mishima and H. E. Stanley, Nature 392, 164 (1998). 10.1038/32386 (Pubitemid 28162785)
    • (1998) Nature , vol.392 , Issue.6672 , pp. 164-166
    • Mishima, O.1    Stanley, H.E.2
  • 9
    • 4243645307 scopus 로고    scopus 로고
    • 10.1103/PhysRevLett.85.334
    • O. Mishima, Phys. Rev. Lett. 85, 334 (2000). 10.1103/PhysRevLett.85.334
    • (2000) Phys. Rev. Lett. , vol.85 , pp. 334
    • Mishima, O.1
  • 11
    • 21744456963 scopus 로고    scopus 로고
    • Experimental evidence of a liquid-liquid transition in interfacial water
    • DOI 10.1209/epl/i2004-10529-2
    • J. M. Zanotti, M. C. Bellissent -Funel, and S. H. Chen, Europhys. Lett. 71, 91 (2005). 10.1209/epl/i2004-10529-2 (Pubitemid 40945350)
    • (2005) Europhysics Letters , vol.71 , Issue.1 , pp. 91-97
    • Zanotti, J.-M.1    Bellissent-Funel, M.-C.2    Chen, S.-H.3
  • 12
    • 33750974749 scopus 로고    scopus 로고
    • Liquid-liquid transition in supercooled water investigated by interaction with LiCl and Xe
    • DOI 10.1063/1.2400038
    • R. Souda, J. Chem. Phys. 125, 181103 (2006). 10.1063/1.2400038 (Pubitemid 44749456)
    • (2006) Journal of Chemical Physics , vol.125 , Issue.18 , pp. 181103
    • Souda, R.1
  • 15
    • 33750686578 scopus 로고    scopus 로고
    • Scaled equation of state for supercooled water near the liquid-liquid critical point
    • DOI 10.1103/PhysRevLett.97.195702
    • D. A. Fuentevilla and M. A. Anisimov, Phys. Rev. Lett. 97, 195702 (2006). 10.1103/PhysRevLett.97.195702 (Pubitemid 44707955)
    • (2006) Physical Review Letters , vol.97 , Issue.19 , pp. 195702
    • Fuentevilla, D.A.1    Anisimov, M.A.2
  • 16
    • 18144365354 scopus 로고    scopus 로고
    • 10.1063/1.472354
    • H. Tanaka, J. Chem. Phys. 105, 5099 (1996). 10.1063/1.472354
    • (1996) J. Chem. Phys. , vol.105 , pp. 5099
    • Tanaka, H.1
  • 17
    • 0000835084 scopus 로고    scopus 로고
    • 10.1038/380328a0
    • H. Tanaka, Nature 380, 328 (1996). 10.1038/380328a0
    • (1996) Nature , vol.380 , pp. 328
    • Tanaka, H.1
  • 20
    • 27144463970 scopus 로고    scopus 로고
    • Pressure dependence of fragile-to-strong transition and a possible second critical point in supercooled confined water
    • DOI 10.1103/PhysRevLett.95.117802, 117802
    • L. Liu, S. H. Chen, A. Faraone, C. W. Yen, and C. Y. Mou, Phys. Rev. Lett. 95, 117802 (2005). 10.1103/PhysRevLett.95.117802 (Pubitemid 41509209)
    • (2005) Physical Review Letters , vol.95 , Issue.11 , pp. 1-4
    • Liu, L.1    Chen, S.-H.2    Faraone, A.3    Yen, C.-W.4    Mou, C.-Y.5
  • 26
    • 63649112869 scopus 로고    scopus 로고
    • 10.1063/1.3103950
    • G. P. Johari, J. Chem. Phys. 130, 124518 (2009). 10.1063/1.3103950
    • (2009) J. Chem. Phys. , vol.130 , pp. 124518
    • Johari, G.P.1
  • 30
    • 0001642888 scopus 로고
    • 10.1103/PhysRevB.48.3591
    • M. van Thiel and F. H. Ree, Phys. Rev. E 48, 3591 (1993). 10.1103/PhysRevB.48.3591
    • (1993) Phys. Rev. e , vol.48 , pp. 3591
    • Van Thiel, M.1    Ree, F.H.2
  • 31
    • 0000393814 scopus 로고    scopus 로고
    • 10.1103/PhysRevLett.79.2474
    • M. Togaya, Phys. Rev. Lett. 79, 2474 (1997). 10.1103/PhysRevLett.79.2474
    • (1997) Phys. Rev. Lett. , vol.79 , pp. 2474
    • Togaya, M.1
  • 34
    • 7444237150 scopus 로고    scopus 로고
    • Critical-like phenomena associated with liquid-liquid transition in a molecular liquid
    • DOI 10.1126/science.1103073
    • R. Kurita and H. Tanaka, Science 306, 845 (2004). 10.1126/science.1103073 (Pubitemid 39446988)
    • (2004) Science , vol.306 , Issue.5697 , pp. 845-848
    • Kurita, R.1    Tanaka, H.2
  • 40
    • 27744520657 scopus 로고    scopus 로고
    • How the liquid-liquid transition affects hydrophobic hydration in deeply supercooled water
    • DOI 10.1103/PhysRevLett.94.217802, 217802
    • D. Paschek, Phys. Rev. Lett. 94, 217802 (2005). 10.1103/PhysRevLett.94. 217802 (Pubitemid 41636708)
    • (2005) Physical Review Letters , vol.94 , Issue.21 , pp. 1-4
    • Paschek, D.1
  • 41
    • 22944433199 scopus 로고    scopus 로고
    • Liquid-vapor and liquid-liquid phase equilibria of the Brodholt-Sampoli- Vallauri polarizable water model
    • DOI 10.1063/1.1855886, 081101
    • P. Jedlovszky and R. Vallauri, J. Chem. Phys. 122, 081101 (2005). 10.1063/1.1855886 (Pubitemid 41047440)
    • (2005) Journal of Chemical Physics , vol.122 , Issue.8 , pp. 1-4
    • Jedlovszky, P.1    Vallauri, R.2
  • 44
    • 4243994760 scopus 로고    scopus 로고
    • 10.1103/PhysRevLett.82.4659
    • J. N. Glosli and F. H. Ree, Phys. Rev. Lett. 82, 4659 (1999). 10.1103/PhysRevLett.82.4659
    • (1999) Phys. Rev. Lett. , vol.82 , pp. 4659
    • Glosli, J.N.1    Ree, F.H.2
  • 46
    • 0000442348 scopus 로고    scopus 로고
    • 10.1103/PhysRevLett.84.4629
    • D. J. Lacks, Phys. Rev. Lett. 84, 4629 (2000). 10.1103/PhysRevLett.84. 4629
    • (2000) Phys. Rev. Lett. , vol.84 , pp. 4629
    • Lacks, D.J.1
  • 47
    • 0012396311 scopus 로고    scopus 로고
    • I. Saika-Voivod,. 10.1103/PhysRevE.63.011202
    • I. Saika-Voivod, F. Sciortino, and P. H. Poole, Phys. Rev. E 63, 011202 (2001). 10.1103/PhysRevE.63.011202
    • (2001) Phys. Rev. e , vol.63 , pp. 011202
    • Sciortino, F.1    Poole, P.H.2
  • 49
    • 0037079218 scopus 로고    scopus 로고
    • A simple statistical mechanical model of water
    • DOI 10.1021/jp021418h
    • T. M. Truskett and K. A. Dill, J. Phys. Chem. B 106, 11829 (2002). 10.1021/jp021418h (Pubitemid 35390235)
    • (2002) Journal of Physical Chemistry B , vol.106 , Issue.45 , pp. 11829-11842
    • Truskett, T.M.1    Dill, K.A.2
  • 50
    • 48449098846 scopus 로고    scopus 로고
    • 10.1016/j.physa.2007.08.043
    • M. I. Marques, Physica A 386, 708 (2007). 10.1016/j.physa.2007.08.043
    • (2007) Physica A , vol.386 , pp. 708
    • Marques, M.I.1
  • 55
    • 0001327328 scopus 로고    scopus 로고
    • 10.1063/1.480241
    • E. A. Jagla, J. Chem. Phys. 111, 8980 (1999). 10.1063/1.480241
    • (1999) J. Chem. Phys. , vol.111 , pp. 8980
    • Jagla, E.A.1
  • 56
    • 0141637310 scopus 로고    scopus 로고
    • 10.1103/PhysRevE.63.061509
    • E. A. Jagla, Phys. Rev. E 63, 061509 (2001). 10.1103/PhysRevE.63.061509
    • (2001) Phys. Rev. e , vol.63 , pp. 061509
    • Jagla, E.A.1
  • 57
    • 0035825620 scopus 로고    scopus 로고
    • Generic mechanism for generating a liquid-liquid phase transition
    • DOI 10.1038/35055514
    • G. Franzese, G. Malescio, A. Skibinsky, S. V. Buldyrev, and H. E. Stanley, Nature 409, 692 (2001). 10.1038/35055514 (Pubitemid 32144510)
    • (2001) Nature , vol.409 , Issue.6821 , pp. 692-695
    • Franzese, G.1    Malescio, G.2    Skibinsky, A.3    Buldyrev, S.V.4    Stanley, H.E.5
  • 62
    • 35649013252 scopus 로고    scopus 로고
    • Differences between discontinuous and continuous soft-core attractive potentials: The appearance of density anomaly
    • DOI 10.1016/j.molliq.2007.08.021, PII S016773220700150X, EMLG/JMLG 2006
    • G. Franzese, J. Mol. Liq. 136, 267 (2007). 10.1016/j.molliq.2007.08.021 (Pubitemid 350026103)
    • (2007) Journal of Molecular Liquids , vol.136 , Issue.3 , pp. 267-273
    • Franzese, G.1
  • 63
    • 34547295891 scopus 로고    scopus 로고
    • Phase behavior of attractive and repulsive ramp fluids: Integral equation and computer simulation studies
    • DOI 10.1063/1.2748043
    • E. Lomba, N. G. Almarza, C. Martin, and C. McBride, J. Chem. Phys. 126, 244510 (2007). 10.1063/1.2748043 (Pubitemid 47141432)
    • (2007) Journal of Chemical Physics , vol.126 , Issue.24 , pp. 244510
    • Lomba, E.1    Almarza, N.G.2    Martin, C.3    McBride, C.4
  • 73
    • 29244471731 scopus 로고    scopus 로고
    • A general purpose model for the condensed phases of water: TIP4P/2005
    • DOI 10.1063/1.2121687, 234505
    • J. L. F. Abascal and C. Vega, J. Chem. Phys. 123, 234505 (2005). 10.1063/1.2121687 (Pubitemid 41828986)
    • (2005) Journal of Chemical Physics , vol.123 , Issue.23 , pp. 1-12
    • Abascal, J.L.F.1    Vega, C.2
  • 77
    • 33746311995 scopus 로고    scopus 로고
    • Vapor-liquid equilibria from the triple point up to the critical point for the new generation of TIP4P-like models: TIP4P/Ew, TIP4P/2005, and TIP4P/ice
    • DOI 10.1063/1.2215612
    • C. Vega, J. L. F. Abascal, and I. Nezbeda, J. Chem. Phys. 125, 034503 (2006). 10.1063/1.2215612 (Pubitemid 44107144)
    • (2006) Journal of Chemical Physics , vol.125 , Issue.3 , pp. 034503
    • Vega, C.1    Abascal, J.L.F.2    Nezbeda, I.3
  • 83
    • 34247515172 scopus 로고    scopus 로고
    • The Widom line of supercooled water
    • DOI 10.1088/0953-8984/19/20/205126, PII S0953898407416514
    • G. Franzese and H. E. Stanley, J. Phys. Condens. Matter 19, 205126 (2007). 10.1088/0953-8984/19/20/205126 (Pubitemid 46653758)
    • (2007) Journal of Physics Condensed Matter , vol.19 , Issue.20 , pp. 205126
    • Franzese, G.1    Stanley, H.E.2
  • 89
    • 84943502952 scopus 로고
    • 10.1080/00268978400101201
    • S. Nos, Mol. Phys. 52, 255 (1984). 10.1080/00268978400101201
    • (1984) Mol. Phys. , vol.52 , pp. 255
    • Nos, S.1
  • 90
    • 0001538909 scopus 로고
    • 10.1103/PhysRevA.31.1695
    • W. G. Hoover, Phys. Rev. A 31, 1695 (1985). 10.1103/PhysRevA.31.1695
    • (1985) Phys. Rev. A , vol.31 , pp. 1695
    • Hoover, W.G.1
  • 93
    • 23844484216 scopus 로고    scopus 로고
    • Liquid-liquid phase transitions in supercooled water studied by computer simulations of various water models
    • DOI 10.1063/1.1992481, 044515
    • I. Brovchenko, A. Geiger, and A. Oleinikova, J. Chem. Phys. 123, 044515 (2005). 10.1063/1.1992481 (Pubitemid 41164747)
    • (2005) Journal of Chemical Physics , vol.123 , Issue.4 , pp. 359-374
    • Brovchenko, I.1    Geiger, A.2    Oleinikova, A.3
  • 95
    • 0037187632 scopus 로고    scopus 로고
    • Molecular dynamics simulation of the ice nucleation and growth process leading to water freezing
    • DOI 10.1038/416409a
    • M. Matsumoto, S. Saito, and I. Ohmine, Nature 416, 409 (2002). 10.1038/416409a (Pubitemid 34272871)
    • (2002) Nature , vol.416 , Issue.6879 , pp. 409-413
    • Matsumoto, M.1    Saito, S.2    Ohmine, I.3
  • 96
    • 34547649512 scopus 로고    scopus 로고
    • R. Garca Fernndez,. 10.1063/1.2183308
    • R. Garca Fernndez, J. L. F. Abascal, and C. Vega, J. Chem. Phys. 124, 144506 (2006). 10.1063/1.2183308
    • (2006) J. Chem. Phys. , vol.124 , pp. 144506
    • Abascal, J.L.F.1    Vega, C.2
  • 99
    • 0030806177 scopus 로고    scopus 로고
    • Enhancement of protein crystal nucleation by critical density fluctuations
    • DOI 10.1126/science.277.5334.1975
    • P. R. tenWolde and D. Frenkel, Science 277, 1975 (1997). 10.1126/science.277.5334.1975 (Pubitemid 27449135)
    • (1997) Science , vol.277 , Issue.5334 , pp. 1975-1978
    • Ten Wolde, P.R.1    Frenkel, D.2
  • 101
    • 34547250242 scopus 로고    scopus 로고
    • Dipole-quadrupole force ratios determine the ability of potential models to describe the phase diagram of water
    • DOI 10.1103/PhysRevLett.98.237801
    • J. L. F. Abascal and C. Vega, Phys. Rev. Lett. 98, 237801 (2007). 10.1103/PhysRevLett.98.237801 (Pubitemid 47139802)
    • (2007) Physical Review Letters , vol.98 , Issue.23 , pp. 237801
    • Abascal, J.L.F.1    Vega, C.2
  • 102
    • 36049012415 scopus 로고    scopus 로고
    • The water forcefield: Importance of dipolar and quadrupolar interactions
    • DOI 10.1021/jp074418w
    • J. L. F. Abascal and C. Vega, J. Phys. Chem. C 111, 15811 (2007). 10.1021/jp074418w (Pubitemid 350097646)
    • (2007) Journal of Physical Chemistry C , vol.111 , Issue.43 , pp. 15811-15822
    • Abascal, J.L.F.1    Vega, C.2
  • 106
    • 18744375794 scopus 로고    scopus 로고
    • The melting temperature of the most common models of water
    • DOI 10.1063/1.1862245, 114507
    • C. Vega, E. Sanz, and J. L. F. Abascal, J. Chem. Phys. 122, 114507 (2005). 10.1063/1.1862245 (Pubitemid 40665538)
    • (2005) Journal of Chemical Physics , vol.122 , Issue.11 , pp. 1-9
    • Vega, C.1    Sanz, E.2    Abascal, J.L.F.3
  • 107
    • 34250006059 scopus 로고    scopus 로고
    • Effect of confinement on the liquid-liquid phase transition of supercooled water
    • DOI 10.1063/1.2734963
    • I. Brovchenko and A. Oleinikova, J. Chem. Phys. 126, 214701 (2007). 10.1063/1.2734963 (Pubitemid 46887353)
    • (2007) Journal of Chemical Physics , vol.126 , Issue.21 , pp. 214701
    • Brovchenko, I.1    Oleinikova, A.2
  • 108
    • 0345412048 scopus 로고    scopus 로고
    • 10.1016/j.physa.2003.08.003
    • S. V. Buldyrev and H. E. Stanley, Physica A 330, 124 (2003). 10.1016/j.physa.2003.08.003
    • (2003) Physica A , vol.330 , pp. 124
    • Buldyrev, S.V.1    Stanley, H.E.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.