메뉴 건너뛰기




Volumn 133, Issue 1-4, 1996, Pages 53-65

Monte Carlo simulation of H2O-CO2 mixtures to 1073.15 K and 30 kbar

Author keywords

Excess properties; Statistical thermodynamics

Indexed keywords

CRUSTAL FLUID; MANTLE FLUID; MONTE CARLO METHOD; THERMODYNAMICS; WATER/CARBON DIOXIDE MIXTURE;

EID: 0030429597     PISSN: 00092541     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2541(96)00069-1     Document Type: Article
Times cited : (31)

References (26)
  • 1
    • 11644276026 scopus 로고
    • Taming the Ewald Sum in the computer simulation of charged systems
    • Adams, D.J. and Dubey, G.S., 1987. Taming the Ewald Sum in the computer simulation of charged systems. J. Comput. Phys., 72: 156-176.
    • (1987) J. Comput. Phys. , vol.72 , pp. 156-176
    • Adams, D.J.1    Dubey, G.S.2
  • 3
    • 0025671216 scopus 로고
    • Molecular dynamics of water at high temperatures and pressures
    • Brodholt, J.P. and Wood, B.J., 1990. Molecular dynamics of water at high temperatures and pressures. Geochim. Cosmochim. Acta, 54: 2611-2616.
    • (1990) Geochim. Cosmochim. Acta , vol.54 , pp. 2611-2616
    • Brodholt, J.P.1    Wood, B.J.2
  • 4
    • 0027445985 scopus 로고
    • 2 mixtures at high pressures and temperatures
    • 2 mixtures at high pressures and temperatures. Am. Mineral., 78: 558-564.
    • (1993) Am. Mineral. , vol.78 , pp. 558-564
    • Brodholt, J.P.1    Wood, B.J.2
  • 5
    • 0027387933 scopus 로고
    • Simulations of the structure and thermodynamic properties of water at high pressures and temperatures
    • Brodholt, J.P. and Wood, B.J., 1993b. Simulations of the structure and thermodynamic properties of water at high pressures and temperatures. J. Geophys. Res., 98: 519-536.
    • (1993) J. Geophys. Res. , vol.98 , pp. 519-536
    • Brodholt, J.P.1    Wood, B.J.2
  • 6
    • 0028193854 scopus 로고
    • Measurements of the PVT properties of water to 25 kbars and 1600 degrees C
    • Brodholt, J.P. and Wood, B.J., 1994. Measurements of the PVT properties of water to 25 kbars and 1600 degrees C. Geochim. Cosmochim. Acta, 58: 2143-2148.
    • (1994) Geochim. Cosmochim. Acta , vol.58 , pp. 2143-2148
    • Brodholt, J.P.1    Wood, B.J.2
  • 7
    • 0001813828 scopus 로고
    • The specific volume of water in the range 1000 to 8900 bars, 20° to 900°C
    • Burnham, C.W., Holloway, J.R. and Davis, N.F., 1969. The specific volume of water in the range 1000 to 8900 bars, 20° to 900°C. Am. J. Sci., 276a: 70-95.
    • (1969) Am. J. Sci. , vol.276 A , pp. 70-95
    • Burnham, C.W.1    Holloway, J.R.2    Davis, N.F.3
  • 9
    • 84943467230 scopus 로고
    • Thermische eigenschaften überkritischer mischungen von kohlendioxyd und wasser bis zu 750°c und 2000 atm
    • Franck, E.U. and Tödheide, K., 1959. Thermische Eigenschaften überkritischer Mischungen von Kohlendioxyd und Wasser bis zu 750°C und 2000 Atm. Z. Phys. Chem., Neue Folge, 22: 232-245.
    • (1959) Z. Phys. Chem., Neue Folge , vol.22 , pp. 232-245
    • Franck, E.U.1    Tödheide, K.2
  • 10
    • 0005848432 scopus 로고
    • The compressibility of gaseous mixtures of carbon dioxide and water between 0 and 500 bars pressure and 450° and 800° centigrade
    • Greenwood, H.J., 1969. The compressibility of gaseous mixtures of carbon dioxide and water between 0 and 500 bars pressure and 450° and 800° centigrade. Am. J. Sci., 267A: 191-208.
    • (1969) Am. J. Sci. , vol.267 A , pp. 191-208
    • Greenwood, H.J.1
  • 11
    • 0041712693 scopus 로고
    • 2 between 450° and 800°C and 0 to 500 bar
    • 2 between 450° and 800°C and 0 to 500 bar. Am. J. Sci., 273: 561-571.
    • (1973) Am. J. Sci. , vol.273 , pp. 561-571
    • Greenwood, H.J.1
  • 12
    • 84906391926 scopus 로고
    • Temperature and size dependence for Monte Carlo simulations of TIP4P water
    • Jorgensen, W.L. and Madura, J.D., 1985. Temperature and size dependence for Monte Carlo simulations of TIP4P water. Mol. Phys., 56: 1381-1392.
    • (1985) Mol. Phys. , vol.56 , pp. 1381-1392
    • Jorgensen, W.L.1    Madura, J.D.2
  • 13
    • 0004016501 scopus 로고
    • Comparison of simple potential functions for simulating liquid water
    • Jorgensen, W.L., Chandradekha, J. and Madura, J.D., 1983. Comparison of simple potential functions for simulating liquid water. J. Chem. Phys., 79: 929-935.
    • (1983) J. Chem. Phys. , vol.79 , pp. 929-935
    • Jorgensen, W.L.1    Chandradekha, J.2    Madura, J.D.3
  • 14
    • 5344270108 scopus 로고
    • Monte Carlo simulations of water under supercritical conditions, i. Thermodynamic and structural properties
    • Kalinichev, A.G., 1991. Monte Carlo simulations of water under supercritical conditions, I. Thermodynamic and structural properties. Z. Naturforsch., 46a: 433-444.
    • (1991) Z. Naturforsch. , vol.46 A , pp. 433-444
    • Kalinichev, A.G.1
  • 15
    • 0008937444 scopus 로고
    • 2 at elevated temperatures and pressures
    • 2 at elevated temperatures and pressures. Am. J. Sci., 252: 225-241.
    • (1954) Am. J. Sci. , vol.252 , pp. 225-241
    • Kennedy, G.C.1
  • 16
    • 0019681437 scopus 로고
    • 2 mixtures at elevated pressures and temperatures
    • 2 mixtures at elevated pressures and temperatures. Am. J. Sci., 281: 735-767.
    • (1981) Am. J. Sci. , vol.281 , pp. 735-767
    • Kerrick, D.M.1    Jacobs, G.K.2
  • 17
    • 0002967487 scopus 로고
    • 2 mixtures: A review of P-V-T-X data and an assessment from a phase-equilibrium point of view
    • 2 mixtures: a review of P-V-T-X data and an assessment from a phase-equilibrium point of view. Can. Mineral., 29: 767-790.
    • (1991) Can. Mineral. , vol.29 , pp. 767-790
    • Mäder, U.K.1
  • 20
    • 33751137166 scopus 로고
    • Interaction site models for carbon dioxide
    • Murthy, C.S., Singer, K. and McDonald, I.R., 1981. Interaction site models for carbon dioxide. Mol. Phys., 44: 135-143.
    • (1981) Mol. Phys. , vol.44 , pp. 135-143
    • Murthy, C.S.1    Singer, K.2    McDonald, I.R.3
  • 21
    • 84946342784 scopus 로고
    • Electrostatic interactions in molecular crystals: Lattice dynamics of solid nitrogen and carbon dioxide
    • Murthy, C.S., Singer, K. and McDonald, I.R., 1983. Electrostatic interactions in molecular crystals: lattice dynamics of solid nitrogen and carbon dioxide. Mol. Phys., 50: 531-541.
    • (1983) Mol. Phys. , vol.50 , pp. 531-541
    • Murthy, C.S.1    Singer, K.2    McDonald, I.R.3
  • 22
    • 0005805835 scopus 로고
    • 2 at temperatures from 100 to 1000°c and pressures from 2000 to 10000 bar
    • presented by Academician Dr. Korzhinsky
    • 2 at temperatures from 100 to 1000°C and pressures from 2000 to 10000 bar. Dokl. Akad. Nauk S.S.S.R., Vol. 227 (presented by Academician Dr. Korzhinsky).
    • (1974) Dokl. Akad. Nauk S.S.S.R. , vol.227
    • Shmonov, V.M.1    Shmulovich, K.I.2
  • 26
    • 0040649419 scopus 로고
    • 2 system at 300°C and 400°C up to 1000 bar
    • in Russian
    • 2 system at 300°C and 400°C up to 1000 bar. Geokhimiya, 6: 805-811 (in Russian).
    • (1984) Geokhimiya , vol.6 , pp. 805-811
    • Zakirov, I.V.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.