Citation: | Hui Wang, Zhifang Chai, Dongqi Wang. Influence of anions on the adsorption of uranyl on hydroxylated α-SiO2(001): A first-principles study. Green Energy&Environment, 2017, 2(1): 30-41. doi: 10.1016/j.gee.2016.11.011 |
[1] |
D.-M.François Environ. Sci. Technol., 48 (2014),pp. 25-26
|
[2] |
M.Pavelescu, A.Pavelescu, A.Sandulescu Rom. J. Phys., 50 (2005),pp. 473-491
|
[3] |
W.Runde Los Alamos Sci., 26 (2000),pp. 392-411
|
[4] |
I.Grenthe, R.J.M.Fuger, R.J.Konings, et al.
|
[5] |
G.R.Choppin J. Radioanal. Nucl. Chem., 273 (2007),pp. 695-703
|
[6] |
D.L.Clark, D.E.Hobart, M.P.Neu Chem. Rev., 95 (1995),pp. 25-48
|
[7] |
T.Reich, H.Moll, T.Arnold, et al. J. Electron. Spectrosc., 96 (1998),pp. 237-243
|
[8] |
E.R.Sylwester, E.A.Hudson, P.G.Allen Geochim. Cosmochim. Acta, 64 (2000),pp. 2431-2438
|
[9] |
J.D.Prikryl, A.Jain, D.R.Turner, et al. J. Contam. Hydrol., 47 (2001),pp. 241-253
|
[10] |
H.Zhang, Z.Tao J. Radioanal. Nucl. Chem., 254 (2002),pp. 103-107
|
[11] |
A.Froideval, M.Del Nero, R.Barillon, et al. J. Colloid Interf. Sci., 266 (2003),pp. 221-235
|
[12] |
T.Arnold, S.Utsunomiya, G.Geipel, et al. Environ. Sci. Technol., 40 (2006),pp. 4646-4652
|
[13] |
J.N.Malin, J.G.Holland, S.A.Saslow, et al. J. Phys. Chem. C, 115 (2011),pp. 13353-13360
|
[14] |
H.Zhang, C.Wen, Z.Tao, et al. J. Radioanal. Nucl. Chem., 287 (2011),pp. 13-20
|
[15] |
E.S.Ilton, Z.Wang, J.F.Boily, et al. Environ. Sci. Technol., 46 (2012),pp. 6604-6611
|
[16] |
A.S.Kar, S.Kumar, B.S.Tomar Colloid Surf. A Physicochem. Eng. Asp., 395 (2012),pp. 240-247
|
[17] |
E.K.Lesher, B.D.Honeyman, J.F.Ranville Geochim. Cosmochim. Acta, 109 (2013),pp. 127-142
|
[18] |
U.Gabriel, L.Charlet, C.W.Schlapfer, et al. J. Colloid Interf. Sci., 239 (2001),pp. 358-368
|
[19] |
R.Steudtner, S.Sachs, K.Schmeide, et al. Radiochim. Acta, 99 (2011),pp. 687-692
|
[20] |
E.S.Ilton, J.S.Lazama Pacheco, J.R.Bargar, et al. Environ. Sci. Technol., 46 (2012),pp. 9428-9436
|
[21] |
D.M.Singer, S.M.E.Chatman, E.S.Ilton, et al. Environ. Sci. Technol., 46 (2012),pp. 3811-3820
|
[22] |
D.M.Singer, S.M.E.Chatman, E.S.Ilton, et al. Environ. Sci. Technol., 46 (2012),pp. 3821-3830
|
[23] |
S.N.Kerisit, A.R.Felmy, E.S.Ilton Environ. Sci. Technol., 45 (2011),pp. 2770-2776
|
[24] |
E.S.Ilton, J.F.Boily, E.C.Buck, et al. Environ. Sci. Technol., 44 (2010),pp. 170-176
|
[25] |
E.S.Ilton, A.Haiduc, C.L.Cahill, et al. Inorg. Chem., 44 (2005),pp. 2986-2988
|
[26] |
T.I.Docrat, J.F.W.Mosselmans, J.M.Charnock, et al. Inorg. Chem., 38 (1999),pp. 1879-1882
|
[27] |
S.Amayri, T.Reich, T.Arnold, et al. J. Solid State Chem., 178 (2005),pp. 567-577
|
[28] |
J.Vázquez, C.Bo, J.M.Poblet, et al. Inorg. Chem., 42 (2003),pp. 6136-6141
|
[29] |
K.Mereiter Acta Crystallogr., C44 (1998),pp. 1175-1178
|
[30] |
A.Coda, A.Della Giusta, V.Tazzoli Acta Crystallogr., B37 (1981),pp. 1496-1500
|
[31] |
G.Meinrath J. Radioanal. Nucl. Chem., 211 (1996),pp. 349-362
|
[32] |
A.Anderson, C.Chieh, D.E.Irish, et al. Can. J. Chem., 58 (1980),pp. 1651-1658
|
[33] |
R.J.Reeder, M.Nugent, G.M.Lamble, et al. Environ. Sci. Technol., 34 (2000),pp. 638-644
|
[34] |
Y.Suzuki, T.Sato, H.Isobe, et al. Am. Mineral., 90 (2005),pp. 1308-1314
|
[35] |
J.-F.Boily, K.M.Rosso Phys. Chem. Chem. Phys., 13 (2011),pp. 7845-7851
|
[36] |
X.Wang, S.Yang, W.Shi, et al. Environ. Sci. Technol., 49 (2015),pp. 11721-11728
|
[37] |
Y.Sun, S.Yang, Y.Chen, et al. Environ. Sci. Technol., 49 (2015),pp. 4255-4262
|
[38] |
Y.Sun, Z.-Y.Wu, X.Wang, et al. Environ. Sci. Technol., 50 (2016),pp. 4459-4467
|
[39] |
D.M.Sherman, C.L.Peacock, C.G.Hubbard Geochim. Cosmochim. Acta, 72 (2008),pp. 298-310
|
[40] |
A.Singh, J.G.Catalano, K.U.Ulrich, et al. Environ. Sci. Technol., 46 (2012),pp. 6594-6603
|
[41] |
C.Joseph, L.R.Van Loon, A.Jakob, et al. Geochim. Cosmochim. Acta, 109 (2013),pp. 74-89
|
[42] |
A.Křepelová, T.Reich, S.Sachs, et al. J. Colloid Interf. Sci., 319 (2008),pp. 40-47
|
[43] |
S.Sachs, G.Bernhard J. Radioanal. Nucl. Chem., 290 (2011),pp. 17-29
|
[44] |
K.Xia, F.Weesner, W.F.Bleam, et al. Soil Sci. Soc. Am. J., 62 (1998),pp. 1240-1246
|
[45] |
H.Wang, Z.Chai, D.Wang Dalton Trans., 44 (2014),pp. 1646-1654
|
[46] |
Q.J.Pan, S.O.Odoh, A.M.Asaduzzaman, et al. Chem. Eur. J., 18 (2012),pp. 1458-1466
|
[47] |
J.Roques, E.Veilly, E.Simoni Int. J. Mol. Sci., 10 (2009),pp. 2633-2661
|
[48] |
W.Yang, A.Zaoui Appl. Clay Sci., 80–81 (2013),pp. 98-106
|
[49] |
B.Martorell, A.Kremleva, S.Krüger, et al. J. Phys. Chem. C, 114 (2010),pp. 13287-13294
|
[50] |
A.Kremleva, S.Krüger, N.Rösch Radiochim. Acta, 98 (2010),pp. 635-646
|
[51] |
X.Tan, M.Fang, X.Wang Molecules, 15 (2010),pp. 8431-8468
|
[52] |
V.A.Glezakou, W.A.de Jong J. Phys. Chem. A, 115 (2011),pp. 1257-1263
|
[53] |
A.A.Skelton, D.J.Wesolowski, P.T.Cummings Langmuir, 27 (2011),pp. 8700-8709
|
[54] |
K.Sebbari, J.Roques, E.Simoni, et al. Surf. Sci., 606 (2012),pp. 1135-1141
|
[55] |
D.Wang, W.F.van Gunsteren, Z.Chai Chem. Soc. Rev., 41 (2012),pp. 5836-5865
|
[56] |
X.Tan, M.Fang, X.Wang Molecules, 15 (2010),pp. 8431-8468
|
[57] |
A.Kremleva, S.Krüger, N.Rösch Geochim. Cosmochimi. Acta, 75 (2011),pp. 706-718
|
[58] |
G.Kresse, J.Hafner Phys. Rev. B, 47 (1993),pp. 558-561
|
[59] |
G.Kresse, J.Furthermüller Phys. Rev. B, 54 (1996),pp. 11169-11186
|
[60] |
J.P.Perdew, K.Burke, M.Ernzerhof Phys. Rev. Lett., 77 (1996),pp. 3865-3868
|
[61] |
P.E.Blöchl Phys. Rev. B, 50 (1994),pp. 17953-17979
|
[62] |
G.Kresse, D.Joubert Phys. Rev. B, 59 (1999),pp. 1758-1775
|
[63] |
http://cms.mpi.univie.ac.at/vasp/vasp/vasp.html VASP the GUIDE. Vienna, March 26, 2015.
|
[64] |
K.Mathew, R.Sundararaman, K.Letchworth-Weaver, et al. J. Chem. Phys., 140 (2014)
|
[65] |
H.-R.Schulten Fresenius J. Anal. Chem., 351 (1995),pp. 62-73
|
[66] |
M.Sundararajan, G.Rajaraman, S.K.Ghosh Phys. Chem. Chem. Phys., 13 (2011),pp. 18038-18046
|
[67] |
P.C.Burns, C.M.Alexopoulos, P.J.Hotchkiss, et al. J. Inorg. Chem., 43 (2004),pp. 1816-1818
|
[68] |
W.A.de Jong, E.Aprà, T.L.Windus, et al. J. Phys. Chem. A, 109 (2005),pp. 11568-11577
|
[69] |
V.E.Jackson, K.E.Gutowski, D.A.Dixon J. Phys. Chem. A, 117 (2013),pp. 8939-8957
|
[70] |
G.A.Barclay, T.M.Sabine, J.C.Taylor Acta Crystallogr., 19 (1965),pp. 205-209
|
[71] |
S.V.Krivovichev, P.C.Burns Radiochemistry, 46 (2004),pp. 16-19
|
[72] |
S.P.McGlynn, J.K.Smith, W.C.Neely J. Chem. Phys., 35 (1961),pp. 105-116
|
[73] |
Q.Y.Wu, J.H.Lan, C.Z.Wang, et al. J. Phys. Chem. A, 118 (2014),pp. 2149-2158
|
[74] |
J.P.Austin, N.A.Burton, I.H.Hillier, et al. Phys. Chem. Chem. Phys., 11 (2009),pp. 1143-1145
|
[75] |
D.Majumdar, K.Balasubramanian, H.Nitsche Chem. Phys. Lett., 361 (2002),pp. 143-151
|
[76] |
D.Majumdar, S.Roszak, K.Balasubramanian, et al. Chem. Phys. Lett., 372 (2003),pp. 232-241
|
[77] |
W.Tang, E.Sanville, G.Henkelman J. Phys. Condens. Matter, 21 (2009)
|
[78] |
E.Sanville, S.D.Kenny, R.Smith, et al. J. Comp. Chem., 28 (2007),pp. 899-908
|
[79] |
G.Henkelman, A.Arnaldsson, H.Jónsson Comput. Mater. Sci., 36 (2006),pp. 254-360
|