SCOPUS 정보 검색 플랫폼

Journal of Physical Chemistry B

Volumn 113, Issue 17, 2009, Pages 5905-5916

Monte Carlo simulations of salt solutions: Exploring the validity of primitive models

(3) Abbas, Zareen a Ahlberg, Elisabet a Nordholm, Sture a

a UNIVERSITY OF GOTHENBURG (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

ALKALINE EARTH METALS; DISSOLUTION; ELECTROLYTES; MONTE CARLO METHODS; NEGATIVE IONS; OSMOSIS; POSITIVE IONS; SIMULATORS; SODIUM CHLORIDE; THERMODYNAMIC PROPERTIES;

ALKALINE EARTH; CATION RADII; CHARGED HARD SPHERES; CONCENTRATION RANGES; CONSISTENT SETS; DIELECTRIC CONTINUUM; DIFFERENT SIZES; ELECTROLYTE SOLUTIONS; EXPERIMENTAL DATA; ION SIZE ASYMMETRY; IONIC ACTIVITY; IONIC RADIUS; MC SIMULATION; MONTE CARLO SIMULATION; MONTE CARLO SIMULATIONS; OSMOTIC COEFFICIENT; PRIMITIVE MODEL; SALT MIXTURES; SALT SOLUTION;

IONIC STRENGTH;

EID: 66349137057 PISSN: 15206106 EISSN: None Source Type: Journal
DOI: 10.1021/jp808427f Document Type: Article

Times cited : (68)

References (78)

1
- 0003407246
- 2nd ed, Plenum Press: New York, Ionics
- Bockris, J. O'M; Reddy, A. K. N. Modern Electrochemistry, 2nd ed.; Plenum Press: New York, 1998; Vol. 1: Ionics.
- (1998) Modern Electrochemistry , vol.1
- Bockris¹ O'M, J.² Reddy, A.K.N.³

2
- 0347777541
- Marcus, Y. Chem. Rev. 1988, 88, 1475.
- (1988) Chem. Rev , vol.88 , pp. 1475
- Marcus, Y.¹

3
- 0142025560
- Ohtaki, H.; Radnai, T. Chem. Rev. 1993, 93, 1157.
- (1993) Chem. Rev , vol.93 , pp. 1157
- Ohtaki, H.¹ Radnai, T.²

4
- 43149121362
- Bakker, H, J. Chem. Rev. 2008, 708, 1456.
- Bakker, H, J. Chem. Rev. 2008, 708, 1456.

5
- 0000116412
- Lyubartsev, A. P.; Laaksonen, A. Phys. Rev. E 1997, 55, 5689.
- (1997) Phys. Rev. E , vol.55 , pp. 5689
- Lyubartsev, A.P.¹ Laaksonen, A.²

6
- 34547554898
- Hess, B.; Holm, C.; van der Vegt, N. J. Chem. Phys. 2006, 124, 164509.
- (2006) J. Chem. Phys , vol.124 , pp. 164509
- Hess, B.¹ Holm, C.² van der Vegt, N.³

7
- 33745433059
- Gavryushov, S.; Linse, P. J. Phys. Chem. B 2006, 770, 10878.
- (2006) J. Phys. Chem. B , vol.770 , pp. 10878
- Gavryushov, S.¹ Linse, P.²

8
- 33847762280
- Lenart, P. J.; Jusufi, A.; Panagiotopoulos, A. Z. J. Chem. Phys. 2007, 126, 044509.
- (2007) J. Chem. Phys , vol.126 , pp. 044509
- Lenart, P.J.¹ Jusufi, A.² Panagiotopoulos, A.Z.³

9
- 33846098276
- Sanz, E.; Vega, C. J. Chem. Phys. 2007, 126, 014507.
- (2007) J. Chem. Phys , vol.126 , pp. 014507
- Sanz, E.¹ Vega, C.²

10
- 0001056450
- Friedman, H. L. J. Chem. Phys. 1960, 32, 1134.
- (1960) J. Chem. Phys , vol.32 , pp. 1134
- Friedman, H.L.¹

11
- 84906405264
- Caiiey, D. D. J. Chem. Phys. 1967, 46, 3783.
- (1967) J. Chem. Phys , vol.46 , pp. 3783
- Caiiey, D.D.¹

12
- 36849108886
- Card, D. N.; Valleau, J. P. I. J. Chem. Phys. 1970, 52, 6232.
- (1970) J. Chem. Phys , vol.52 , pp. 6232
- Card, D.N.¹ Valleau, J.P.I.²

13
- 0000557463
- Rasaiah, J. C.; Card, D. N.; Valleau, J. P. I. J. Chem. Phys. 1972, 56, 248.
- (1972) J. Chem. Phys , vol.56 , pp. 248
- Rasaiah, J.C.¹ Card, D.N.² Valleau, J.P.I.³

14
- 36749113132
- Valleau, J. P.; Cohen, L. K. J. Chem. Phys. 1980, 72, 5935.
- (1980) J. Chem. Phys , vol.72 , pp. 5935
- Valleau, J.P.¹ Cohen, L.K.²

15
- 36749112543
- Valleau, J. P.; Cohen, L. K.; Card, D. N. J. Chem. Phys. 1980, 72, 5942.
- (1980) J. Chem. Phys , vol.72 , pp. 5942
- Valleau, J.P.¹ Cohen, L.K.² Card, D.N.³

16
- 84952230890
- Van Megen, W.; Snook, I. K. Mot Phys. 1980, 39, 1043.
- (1980) Mot Phys , vol.39 , pp. 1043
- Van Megen, W.¹ Snook, I.K.²

17
- 0000658535
- Rogde, S. A.; Hafskjold, B. Mot Phys. 1983, 48, 1241.
- (1983) Mot Phys , vol.48 , pp. 1241
- Rogde, S.A.¹ Hafskjold, B.²

18
- 0000602167
- Svensson, B. O. R.; Woodward, C. E. Mot Phys. 1988, 64, 247.
- (1988) Mot Phys , vol.64 , pp. 247
- Svensson, B.O.R.¹ Woodward, C.E.²

19
- 45449122687
- Sloth, P.; Sorensen, T. S. Chem. Phys. Lett. 1988, 143, 140-144.
- (1988) Chem. Phys. Lett , vol.143 , pp. 140-144
- Sloth, P.¹ Sorensen, T.S.²

20
- 0037076741
- Hanassab, S.; VanderNoot, T. J. J. Electroanal. Chem. 2002, 528, 135.
- (2002) J. Electroanal. Chem , vol.528 , pp. 135
- Hanassab, S.¹ VanderNoot, T.J.²

21
- 36949033171
- Lamperski, S. Mot Simul. 2007, 33, 1193.
- (2007) Mot Simul , vol.33 , pp. 1193
- Lamperski, S.¹

22
- 0001447439
- Rasaiah, J. C. J. Chem. Phys. 1972, 56, 3071.
- (1972) J. Chem. Phys , vol.56 , pp. 3071
- Rasaiah, J.C.¹

23
- 0000093759
- Rasaiah, J. C.; Friedman, H. J. Chem. Phys. 1968, 48, 2742.
- (1968) J. Chem. Phys , vol.48 , pp. 2742
- Rasaiah, J.C.¹ Friedman, H.²

24
- 0000668290
- Rasaiah, J. C.; Friedman, H. J. Chem. Phys. 1969, 50, 3965.
- (1969) J. Chem. Phys , vol.50 , pp. 3965
- Rasaiah, J.C.¹ Friedman, H.²

25
- 0001557037
- Rasaiah, J. C. J. Chem. Phys. 1970, 52, 704.
- (1970) J. Chem. Phys , vol.52 , pp. 704
- Rasaiah, J.C.¹

26
- 4244138823
- Rogde, S. A. Chem. Phys. Lett. 1983, 103, 133.
- (1983) Chem. Phys. Lett , vol.103 , pp. 133
- Rogde, S.A.¹

27
- 36749116948
- Abramo, M. C.; Caccamo, C.; Pizzimenti, G. J. Chem. Phys. 1983, 78, 357.
- (1983) J. Chem. Phys , vol.78 , pp. 357
- Abramo, M.C.¹ Caccamo, C.² Pizzimenti, G.³

28
- 0001588269
- Abramo, M. C.; Caccamo,; Malescio, G.; Pizzimenti, G.; Rogde, S. A. J. Chem. Phys. 1984, 80, 4396.
- (1984) J. Chem. Phys , vol.80 , pp. 4396
- Abramo, M.C.¹ Caccamo² Malescio, G.³ Pizzimenti, G.⁴ Rogde, S.A.⁵

29
- 0005623227
- Sloth, P.; Sorensen, T. S. Chem. Phys. Lett. 1988, 146, 452.
- (1988) Chem. Phys. Lett , vol.146 , pp. 452
- Sloth, P.¹ Sorensen, T.S.²

30
- 11144288606
- Sloth, P.; Sorensen, T. S. J. Phys. Chem. 1990, 94, 2116.
- (1990) J. Phys. Chem , vol.94 , pp. 2116
- Sloth, P.¹ Sorensen, T.S.²

31
- 84906385453
- Svensson, B.; Akesson, T.; Woodward, C. E. J. Chem. Phys. 1991, 95, 2111,
- (1991) J. Chem. Phys , vol.95 , pp. 2111
- Svensson, B.¹ Akesson, T.² Woodward, C.E.³

32
- 0027883020
- Sorensen, T. S. Mol. Simul. 1993, 11, 1.
- (1993) Mol. Simul , vol.11 , pp. 1
- Sorensen, T.S.¹

33
- 0027881469
- Sorensen, T. S. Mol. Simul. 1993, 11, 267.
- (1993) Mol. Simul , vol.11 , pp. 267
- Sorensen, T.S.¹

34
- 84906365213
- Liano-Restrepo, M.; Chapman, W. G. J. Chem. Phys. 1994, 700, 8321.
- (1994) J. Chem. Phys , vol.700 , pp. 8321
- Liano-Restrepo, M.¹ Chapman, W.G.²

35
- 0001995536
- Corti, H. R.; Laria, D.; Trivani, L. N. J. Chem. Soc, Faraday Trans. 1996, 92, 91.
- (1996) J. Chem. Soc, Faraday Trans , vol.92 , pp. 91
- Corti, H.R.¹ Laria, D.² Trivani, L.N.³

36
- 11144313611
- Hanassab, S.; VanderNoot, T. J. Mol. Simul. 2004, 30, 301.
- (2004) Mol. Simul , vol.30 , pp. 301
- Hanassab, S.¹ VanderNoot, T.J.²

37
- 0001287235
- Triolo, P.; Grigera, J. R.; Blum, L. J. Phys. Chem. 1976, 80, 1858.
- (1976) J. Phys. Chem , vol.80 , pp. 1858
- Triolo, P.¹ Grigera, J.R.² Blum, L.³

38
- 0009531285
- Watanasiri, S.; Brule, M. R.; Lee, L. J. Phys. Chem. 1982, 86, 292.
- (1982) J. Phys. Chem , vol.86 , pp. 292
- Watanasiri, S.¹ Brule, M.R.² Lee, L.³

39
- 0002015160
- Ebeling, W.; Scherwinski, K. Z. Phys. Chem., Liepzig 1983, 264, 1.
- (1983) Phys. Chem., Liepzig , vol.264 , pp. 1
- Ebeling, W.¹ Scherwinski, K.Z.²

40
- 84906371681
- Cord, H. R. J. Phys. Chem. 1987, 97, 686.
- (1987) J. Phys. Chem , vol.97 , pp. 686
- Cord, H.R.¹

41
- 0027593892
- Lu, J-F.; Xin, Y.; Li, Y. G. Fluid Phase Equilib. 1993, 85, 81.
- (1993) Fluid Phase Equilib , vol.85 , pp. 81
- Lu, J.-F.¹ Xin, Y.² Li, Y.G.³

42
- 0000594105
- Sun, T.; Lenard, J-L.; Teja, A. S. J. Phys. Chem. 1994, 98, 6870.
- (1994) J. Phys. Chem , vol.98 , pp. 6870
- Sun, T.¹ Lenard, J.-L.² Teja, A.S.³

43
- 0003605187
- Elsevier Scientific Publishing Co, Amsterdam
- Conway, B. E. Ion Hydration in Chemistry and Biophysics, Studies in physical and theoretical chemistry 12; Elsevier Scientific Publishing Co.: Amsterdam, 1981.
- (1981) Ion Hydration in Chemistry and Biophysics, Studies in physical and theoretical chemistry 12
- Conway, B.E.¹

44
- 32044463112
- Collin, K. D. Biophys Chem. 2006, 119, 271.
- (2006) Biophys Chem , vol.119 , pp. 271
- Collin, K.D.¹

45
- 5744249209
- Metropolis, N.; Rosenbluth, A. W.; Rosenbluth, M. N.; Teller, A. H.; Teller, E. J. Chem. Phys. 1953, 21, 1087.
- (1953) J. Chem. Phys , vol.21 , pp. 1087
- Metropolis, N.¹ Rosenbluth, A.W.² Rosenbluth, M.N.³ Teller, A.H.⁴ Teller, E.⁵

46
- 0042640726
- Widom, B. J. J. Chem. Phys. 1963, 39, 2808.
- (1963) J. Chem. Phys , vol.39 , pp. 2808
- Widom, B.J.¹

47
- 0037283851
- Lund, M.; Jonson, B.; Pederson, T. Mar. Chem. 2003, 80, 95.
- (2003) Mar. Chem , vol.80 , pp. 95
- Lund, M.¹ Jonson, B.² Pederson, T.³

48
- 0004266531
- 2nd ed, Butterworth: London
- Robinson, R. A.; Stokes, R. H. Electrolyte Solutions, 2nd ed.; Butterworth: London, 1970.
- (1970) Electrolyte Solutions
- Robinson, R.A.¹ Stokes, R.H.²

49
- 0037075449
- Abbas, Z.; Gunnarsson, M.; Ahlberg, E.; Nordholm, S. J. Phys. Chem. B 2002, 706, 1403.
- (2002) J. Phys. Chem. B , vol.706 , pp. 1403
- Abbas, Z.¹ Gunnarsson, M.² Ahlberg, E.³ Nordholm, S.⁴

50
- 0000246918
- Hamer, W. J.; Wu, Y-C. J. Phys. Chem. Ref. Data 1972, 7, 1047.
- (1972) J. Phys. Chem. Ref. Data , vol.7 , pp. 1047
- Hamer, W.J.¹ Wu, Y.-C.²

51
- 0017914125
- Goldberg, R. N.; Nuttall, R. L. J. Phys. Chem. Ref. Data 1978, 7, 263.
- (1978) J. Phys. Chem. Ref. Data , vol.7 , pp. 263
- Goldberg, R.N.¹ Nuttall, R.L.²

52
- 33846287514
- Dinane, A. Thermodynamics 2007, 39, 96.
- (2007) Thermodynamics , vol.39 , pp. 96
- Dinane, A.¹

53
- 84906381400
- Friedman, H. L. J. Solution Chem. 1972, 7, 386.
- (1972) J. Solution Chem , vol.7 , pp. 386
- Friedman, H.L.¹

54
- 33751145521
- Simonin, J. P. J. Chem. Soc, Faraday Trans. 1996, 92, 3519.
- (1996) J. Chem. Soc, Faraday Trans , vol.92 , pp. 3519
- Simonin, J.P.¹

55
- 35148897794
- Abbas, Z.; Ahlberg, E.; Nordholm, S. Fluid Phase Equilib. 2007, 260, 233.
- (2007) Fluid Phase Equilib , vol.260 , pp. 233
- Abbas, Z.¹ Ahlberg, E.² Nordholm, S.³

56
- 0032051520
- Haynes, C. A.; Newman, J. Fluid Phase Equilib. 1998, 745, 255.
- (1998) Fluid Phase Equilib , vol.745 , pp. 255
- Haynes, C.A.¹ Newman, J.²

57
- 0037178069
- Myers, J. A.; Sandier, S. I.; Wood, R. H. Ind. Eng. Chem. Res. 2002, 41, 3282.
- (2002) Ind. Eng. Chem. Res , vol.41 , pp. 3282
- Myers, J.A.¹ Sandier, S.I.² Wood, R.H.³

58
- 0346735076
- Bemal, J. D.; Fowler, R. H. J. Chem. Phys. 1933, 7, 515.
- (1933) J. Chem. Phys , vol.7 , pp. 515
- Bemal, J.D.¹ Fowler, R.H.²

59
- 36849117971
- (a) Frank, H. S.; Evans, M. W. J. Chem. Phys. 1945, 13, 507.
- (1945) J. Chem. Phys , vol.13 , pp. 507
- Frank, H.S.¹ Evans, M.W.²

60
- 2542436054
- (b) Frank, H. S.; Wen, W. Y. Discuss Faraday Soc. 1957, 24, 133.
- (1957) Discuss Faraday Soc , vol.24 , pp. 133
- Frank, H.S.¹ Wen, W.Y.²

61
- 0007231567
- (c) Frank, H. S. Z. Phys. Chem. (Leipzig) 1965, 228, 364.
- (1965) Phys. Chem. (Leipzig) , vol.228 , pp. 364
- Frank, H.S.Z.¹

62
- 66349115270
- McGraw-Hill: New York
- Gurney, R. W. Ionic Precesses in Solution; McGraw-Hill: New York, 1953.
- (1953) Ionic Precesses in Solution
- Gurney, R.W.¹

63
- 0038283133
- Chen, T.; Hefter, G.; Buchner, R. J. Phys. Chem B 2003, 707, 4025.
- (2003) J. Phys. Chem B , vol.707 , pp. 4025
- Chen, T.¹ Hefter, G.² Buchner, R.³

64
- 37248998947
- Mancinelli, R.; Botti, A.; Bruni, F.; Ricci, M. A.; Soper, A. K. J. Phys. Chem B 2007, 777, 13570.
- (2007) J. Phys. Chem B , vol.777 , pp. 13570
- Mancinelli, R.¹ Botti, A.² Bruni, F.³ Ricci, M.A.⁴ Soper, A.K.⁵

65
- 0003715646
- Marcel Dekker Inc: New York
- Marcus, Y. Ion Properties; Marcel Dekker Inc: New York. 1997.
- (1997) Ion Properties
- Marcus, Y.¹

66
- 34547139595
- Aziz, E. F.; Zimina, A.; Friewald, M.; Eisebitt, S.; Ebehardt, W. J. Chem. Phys. 2006, 724, 114502.
- (2006) J. Chem. Phys , vol.724 , pp. 114502
- Aziz, E.F.¹ Zimina, A.² Friewald, M.³ Eisebitt, S.⁴ Ebehardt, W.⁵

67
- 1442288296
- Kunz, W.; Belloni, L.; Bernard, O.; Ninham, B. J. Phys. Chem B 2004, 708, 2398.
- (2004) J. Phys. Chem B , vol.708 , pp. 2398
- Kunz, W.¹ Belloni, L.² Bernard, O.³ Ninham, B.⁴

68
- 0015005056
- Lown, D. A.; Thirsk, H. R. Trans. Faraday Soc. 1971, 67, 132.
- (1971) Trans. Faraday Soc , vol.67 , pp. 132
- Lown, D.A.¹ Thirsk, H.R.²

69
- 0013380048
- (a) Sharma, S. K.; Kashyap, S. C. J. Inorg. Nucl. Chem. 1972, 34, 3623.
- (1972) J. Inorg. Nucl. Chem , vol.34 , pp. 3623
- Sharma, S.K.¹ Kashyap, S.C.²

70
- 0005328714
- (b) Sharma, S. K. J. Chem. Phys. 1973, 58, 1626.
- (1973) J. Chem. Phys , vol.58 , pp. 1626
- Sharma, S.K.¹

71
- 0000696965
- Moskovits, M.; Michaelian, K. H. J. Am. Chem. Soc. 1980, 702, 2209.
- (1980) J. Am. Chem. Soc , vol.702 , pp. 2209
- Moskovits, M.¹ Michaelian, K.H.²

72
- 84962426717
- De Proft, F.; Sablon, N.; Tozer, D. J.; Geerlings, P. Phys. Chem. Chem. Phys. 2007, 135, 151.
- (2007) Phys. Chem. Chem. Phys , vol.135 , pp. 151
- De Proft, F.¹ Sablon, N.² Tozer, D.J.³ Geerlings, P.⁴

73
- 34250750162
- Cappa, C. D.; Smith, J. D.; Messer, B. M.; Cohen, R. C.; Saykally, R. J. J. Phys. Chem A 2007, 777, 4776.
- (2007) J. Phys. Chem A , vol.777 , pp. 4776
- Cappa, C.D.¹ Smith, J.D.² Messer, B.M.³ Cohen, R.C.⁴ Saykally, R.J.⁵

74
- 0028133296
- Marcus, Y. Biophys. Chem. 1994, 57, 111.
- (1994) Biophys. Chem , vol.57 , pp. 111
- Marcus, Y.¹

75
- 33750624445
- Marcus, Y. Biophys. Chem. 2006, 724, 200.
- (2006) Biophys. Chem , vol.724 , pp. 200
- Marcus, Y.¹

76
- 33845552750
- Frost, R. L.; James, D. W.; Appleby, R.; Mayes, R. E. J. Phys. Chem. 1982, 86, 3840.
- (1982) J. Phys. Chem , vol.86 , pp. 3840
- Frost, R.L.¹ James, D.W.² Appleby, R.³ Mayes, R.E.⁴

77
- 13444263721
- Botti, A.; Bruni, F.; Imberti, S.; Ricci, M. A.; Soper, A. K. J. Mol. Liq. 2005, 777, 81.
- (2005) J. Mol. Liq , vol.777 , pp. 81
- Botti, A.¹ Bruni, F.² Imberti, S.³ Ricci, M.A.⁴ Soper, A.K.⁵

78
- 34548089465
- Ikeda, T.; Boero, M.; Terakura, K. J. Chem. Phys. 2007, 727, 074503.
- (2007) J. Chem. Phys , vol.727 , pp. 074503
- Ikeda, T.¹ Boero, M.² Terakura, K.³

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.