A density functional approach to retention in chromatography with chemically bonded phases

Journal of Chromatography A

Volumn 1218, Issue 5, 2011, Pages 711-720

  Borowko M ^a   Sokolowski S ^a   Staszewski, T ^a  

^a MARIA CURIE SK ODOWSKA UNIVERSITY   (Poland)

Author keywords

Bonded phases; Density functional theory; Reversed liquid chromatography; Theory of chromatography

Indexed keywords

A-DENSITY; BONDED PHASES; CHAIN MOLECULES; CHEMICALLY BONDED; DENSITY FUNCTIONALS; GRAFTED CHAINS; GRAFTED POLYMERS; GRAFTING DENSITIES; HARD WALLS; LENNARD JONES; REVERSED LIQUID CHROMATOGRAPHY; STATIONARY PHASIS; THEORETICAL PREDICTION; THEORY OF CHROMATOGRAPHY;

GRAFTING (CHEMICAL); LIQUID CHROMATOGRAPHY; LIQUIDS; WALLS (STRUCTURAL PARTITIONS);

DENSITY FUNCTIONAL THEORY;

POLYMER;

ARTICLE; CHEMICAL BOND; CHEMICAL INTERACTION; CHROMATOGRAPHY; CONTROLLED STUDY; DENSITY FUNCTIONAL THEORY; MATHEMATICAL ANALYSIS; MOLECULAR INTERACTION; MONTE CARLO METHOD; PREDICTION; PRIORITY JOURNAL; SOLUTE; TEMPERATURE;

CHROMATOGRAPHY, REVERSE-PHASE; MODELS, CHEMICAL; TEMPERATURE;

EID: 78650945318     PISSN: 00219673     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.chroma.2010.12.029     Document Type: Article

References (88)

1. Dorsey J.G., Dill K.A. Chem. Rev. 1989, 89:331.
2. Tan L.C., Carr P.W. J. Chromatogr. A 1997, 775:1.
3. Jaroniec M., Martire D.E., Borówko M. Adv. Colloid Interface Sci. 1985, 22:177.
4. Schoenmakers P.J. Optimization of Chromatographic Selectivity, A Guide to Method Development, J. Cromatographic Library 1986, vol. 35. Elsevier, Amsterdam.
5. Martire D.E., Boehm R.E. J. Phys. Chem. 1983, 87:1045.
6. Dill K.A. J. Phys. Chem. 1987, 91:1980.
7. Bohmer M.R., Koopal L.K., Tijssen R. J. Phys. Chem. 1991, 95:6285.
8. Leermakers F.A.M., Philipsen H.J.A., Klumperman B. J. Chromatogr. A 2002, 959:37.
9. Fleer G.J., Cohen Stuart A.A., Scheutjens J.M.H.M., Cosgrove T., Vincent B. Polymers at Interfaces 1993, Chapman and Hall, London.
10. Netz R.R., Andelman D. Phys. Rep. 2003, 380:1.
11. Alexander S. J. Phys. (France) 1977, 38:983.
12. de Gennes P.G. Macromolecules 1980, 13:1069.
13. Milner S.T., Witten T.A., Cates M.E. Europhys. Lett. 1988, 5:413.
14. Milner S.T., Witten T.A., Cates M.E. Macromolecules 1988, 21:2610.
15. Milner S.T. Science 1991, 251:905.
16. Zhalina E.B., Borisov O.V., Pryamitsyn V.A., Birshtein T.M. Macromolecules 1991, 24:140.
17. Carignano M.A., Szleifer I. J. Chem. Phys. 1994, 100:3210.
18. Carignano M.A., Szleifer I. Macromolecules 1995, 28:3197.
19. Carignano M.A., Szleifer I. J. Chem. Phys. 1995, 102:8662.
20. McCoy J.D., Teixeira M.A., Curro J.G.J. J. Chem. Phys. 2001, 113:4289.
21. McCoy J.D., Ye Y., Curro J.G.J. J. Chem. Phys. 2002, 117:2075.
22. Ye Y., McCoy J.D., Curro J.G.J. J. Chem. Phys. 2003, 119:555.
23. Yu Y.-X., Wu J. J. Chem. Phys. 2002, 117:2368.
24. Yu Y.-X., Wu J. J. Chem. Phys. 2002, 117:10156.
25. Yu Y.-X., Wu J. J. Chem. Phys. 2003, 118:3835.
26. Cao D.P., Wu J. Langmuir 2006, 22:2712.
27. Bryk P., Pizio O., Sokoł owski S. J. Chem. Phys. 2005, 122:194906.
28. Pizio O., Bucior K., Patrykiejew A., Sokołowski S. J. Chem. Phys. 2005, 123:214902.
29. Borówko M., Rz̈ysko W., Sokołowski S., Staszewski T. J. Chem. Phys. 2007, 126:214703.
30. Borówko M., Rz̈ysko W., Sokołowski S., Staszewski T. J. Phys. Chem. 2009, 113:4763.
31. Klatte S.J., Beck T.L. J. Chem. Phys. 1993, 97:5727.
32. Klatte S.J., Beck T.L. J. Chem. Phys. 1995, 99:160524.
33. Yarovsky I., Aguilar M.I., Hearn M.T. Anal. Chem. 1996, 68:1974.
34. Lippa K.A., Sander L.C., Mountain R.D. Anal. Chem. 2005, 77:7862.
35. Klatte S.J., Beck T.L. J. Chem. Phys. 1996, 100:5931.
36. Sluster J.T., Mountain R.D. J. Phys. Chem. 1999, 103:1354.
37. Ban K., Saito Y., Jinno K. Anal. Sci. 2005, 21:397.
38. Rafferty J.L., Siepmann J.I., Schure M.R. J. Chromatogr. A 2008, 1204:11.
39. Rafferty J.L., Siepmann J.I., Schure M.R. J. Chromatogr. A 2008, 1204:20.
40. Rafferty J.L., Siepmann J.I., Schure M.R. Anal. Chem. 2008, 80:6214.
41. Rafferty J.L., Siepmann J.I., Schure M.R. J. Chromatogr. A 2009, 1216:2320.
42. Doyle C.A., Vickers T.J., Mann C.K., Dorsey J.G. J. Chromatogr. A 2000, 877:25.
43. Doyle C.A., Vickers T.J., Mann C.K., Dorsey J.G. J. Chromatogr. A 2000, 877:41.
44. Orendorf C.J., Ducey M.W., Pemberton J.E., Sander L.C. Anal. Chem. 2003, 75:3360.
45. Pemberton J.E., Ho M., Orendorf C.J. J. Chromatogr. 2001, 913:249.
46. Liao Z., Pemberton J.E. J. Chromatogr. A 2008, 1193:60.
47. Liao Z.H., Pemberton J.E. Anal. Chem. 2008, 80:2911.
48. Ziegler R.C., Maciel G.E. J. Am. Chem. Soc. 1991, 113:6349.
49. Pursch M., Strohschein S., Handel H., Albert K. Anal. Chem. 1996, 68:386.
50. Pursch M., Sander L.C., Egelhaaf H.J., Raitza M., Wise S.A., Oelkrug D., Albert K. J. Am. Chem. Soc. 1999, 121:3201.
51. Montgomery M.E., Green M.A., Wirth M.J. Anal. Chem. 1992, 64:1170.
52. Wirth M.J., Swinton D.J., Ludes M.D. J. Phys. Chem. B 2003, 107:6258.
53. Henry M.C., Wolf L.K., Messmer M.C. J. Phys. Chem. B 2003, 107:2765.
54. Sander L.C., Glinka C.J., Wise S.A. Anal. Chem. 1990, 62:1099.
55. Weeks J.D., Chandler D., Andersen H.C. J. Chem. Phys. 1971, 54:5237.
56. Rosenfeld J. Phys. Rev. Lett. 1989, 63:980.
57. Wertheim M.S. J. Chem. Phys. 1987, 87:7323.
58. Ranutuga R.J., Carr P.W. Anal. Chem. 2000, 72:5679.
59. Lai D.T., Binder K. J. Chem. Phys. 1992, 97:586.
60. Melander W.R., Horvath Cs. High Performance Liquid Chromatography, Advances and Perspectives 1980, vol. 2:201. Academic Press, New York.
61. Snyder L.R., Dolan J.W., Carr P.W. J. Chromatogr. A 2004, 1060:77.
62. Ościk J. Adsorption 1979, Ellis Horwood Publisher, Chichester.
63. Scheutjens J.M.H.M., Fleer G.J., Cohen Stuart M.A. Colloids Surf. 1986, 21:285.
64. Majors R.E., Hopper M.J. Journal of Chromatographic Science 1974, 12:767.
65. Unger K.K., Becker N., Roumeliotis P. J. Chromatogr. 1976, 125:115.
66. Hemetsberger H., Maasfeld W., Ricken H. Chromatographia 1976, 9:303.
67. Hennion M.C., Picard C., Caude M. J. Chromatogr. 1978, 166:21.
68. Miller M.L., Linton R.W., Bush S.G., Jorgenson J.W. Anal. Chem. 1984, 56:2204.
69. Tomellini S.A., Shu S.H., Fazio F.D., Hartwick R.A. J. High Resolut. Chromatogr., Chromatogr. Commun. 1985, 8:337.
70. Kikta E.J., Grushka E. Anal. Chem. 1976, 48:1098.
71. Tanaka N., Goodell H., Karger B.L. J. Chromatogr. 1978, 158:233.
72. Sentell K.B., Dorsey J.G. Anal. Chem. 1989, 61:930.
73. Sentell K.B., Dorsey J.G. J. Chromatogr. 1989, 461:193.
74. Miyabe K., Guiochon G. J. Chromatogr. 1978, 166:21.
75. Gritti F., Guiochon G. J. Chromatogr. A 2006, 1115:142.
76. Horvath C., Melander W., Molnar I. J. Chromatogr. 1976, 125:129.
77. Mockel H.J., Welter G., Meltzer H. J. Chromatogr. 1978, 388:285.
78. Schantz M.M., Martire D.E. J. Chromatogr. 1978, 391:35.
79. Colin H., Krstulovic A.M., Gonnord M.F., Guiochon G., Yun Z., Jandera P. Chromatographia 1983, 17:9.
80. Tchapla A., Colin H., Guiochon G. Anal. Chem. 1984, 56:621.
81. Snyder L.R. J. Chromatogr. 1979, 179:167.
82. Chmielowiec J., Sawatzky H. J. Chromatogr. Sci. 1979, 17:245.
83. Gilpin R.K., Squires A.A. J. Chromatogr. Sci. 1981, 19:195.
84. Dufek P. J. Chromatogr. 1984, 299:109.
85. Grushka E., Colin H., Guiochon G. J. Chromatogr. 1982, 245:325.
86. Issaq H.J., Fox S.D., Lindsey K., McConnell J.H., Weiss D.E. J. Liq. Chromatogr. 1987, 10:49.
87. Krstulovic A.M., Colin H., Tchapla A., Guiochon G. Chromatographia 1989, 117:228.
88. Borówko M., Sokoł owski S., Pizio O. Computational Methods in Surface and Colloid Science 2000, 167. M. Dekker, New York. M. Borówko (Ed.).