-
1
-
-
17144386036
-
-
Eds.; Elsevier: New York.
-
Handbook of Clay Science; Bergaya, F., Theng, B. K. G., Lagaly, G., Eds.; Elsevier: New York, 2006.
-
(2006)
Handbook of Clay Science
-
-
Bergaya, F.1
Theng, B.K.G.2
Lagaly, G.3
-
2
-
-
77649268948
-
Clay swelling: New insights from neutron-based techniques
-
In;, Eds.; Springer: New York,; Chapter 18, p.
-
Bihannic, I.; Delville, A.; Demé, B.; Plazanet, M.; Villieras, F.; Michot, L. Clay swelling: new insights from neutron-based techniques. In Neutron Applications in Earth, Energy and Environmental Sciences; Liang, L., Rinaldi, R., Schober, H., Eds.; Springer: New York, 2009; Chapter 18, p 521.
-
(2009)
Neutron Applications in Earth, Energy and Environmental Sciences
, pp. 521
-
-
Bihannic, I.1
Delville, A.2
Demé, B.3
Plazanet, M.4
Villieras, F.5
Michot, L.6
Liang, L.7
Rinaldi, R.8
Schober, H.9
-
3
-
-
66249142322
-
Linking the diffusion of water in compacted clays a two different time scales: Tracer through-diffusion and quasielastic neutron scattering
-
Sanchez, F. G.; Gimmi, T.; Juranyi, F.; van Loon, L.; Diamond, L. Linking the diffusion of water in compacted clays a two different time scales: tracer through-diffusion and quasielastic neutron scattering Environ. Sci. Technol. 2009, 43, 3487-3493
-
(2009)
Environ. Sci. Technol.
, vol.43
, pp. 3487-3493
-
-
Sanchez, F.G.1
Gimmi, T.2
Juranyi, F.3
Van Loon, L.4
Diamond, L.5
-
4
-
-
0035936329
-
A neutron spin-echo study of confined water
-
DOI 10.1063/1.1420728
-
Swenson, J.; Bergman, R.; Longeville, S. A neutron spin-echo study of confined water J. Chem. Phys. 2001, 115, 11299-11305 (Pubitemid 34040463)
-
(2001)
Journal of Chemical Physics
, vol.115
, Issue.24
, pp. 11299-11305
-
-
Swenson, J.1
Bergman, R.2
Longeville, S.3
-
5
-
-
34547298141
-
Diffusion of water in a synthetic clay with tetrahedral charges by combined neutron time-of-flight measurements and molecular dynamics simulations
-
DOI 10.1021/jp0690446
-
Michot, L.; Delville, A.; Humbert, B.; Plazanet, M.; Levitz, P. Diffusion of water in a synthetic clay with tetrahedral charges by combined neutron time-of-flight measurements and molecular dynamics simulations J. Phys. Chem. C 2007, 111, 9818-9831 (Pubitemid 47155168)
-
(2007)
Journal of Physical Chemistry C
, vol.111
, Issue.27
, pp. 9818-9831
-
-
Michot, L.J.1
Delville, A.2
Humbert, B.3
Plazanet, M.4
Levitz, P.5
-
6
-
-
33644990239
-
Diffusion of water in clays on the microscopic scale: Modeling and experiment
-
Malikova, N.; Cadène, A.; Marry, V.; Dubois, E.; Turq, P. Diffusion of water in clays on the microscopic scale: modeling and experiment J. Phys. Chem. B 2006, 110, 3206-3214
-
(2006)
J. Phys. Chem. B
, vol.110
, pp. 3206-3214
-
-
Malikova, N.1
Cadène, A.2
Marry, V.3
Dubois, E.4
Turq, P.5
-
7
-
-
0035184894
-
Charge homogeneity in synthetic fuorohectorite
-
Breu, J.; Seidl, W.; Stoll, A.; Lange, K.; Probst, T. Charge homogeneity in synthetic fuorohectorite Chem. Mater. 2001, 13, 4213-4220
-
(2001)
Chem. Mater.
, vol.13
, pp. 4213-4220
-
-
Breu, J.1
Seidl, W.2
Stoll, A.3
Lange, K.4
Probst, T.5
-
8
-
-
77949377997
-
Connecting the molecular scale to the continuum scale for diffusion processes in smectite-rich porous media
-
Bourg, I.; Sposito, G. Connecting the molecular scale to the continuum scale for diffusion processes in smectite-rich porous media Environ. Sci. Technol. 2010, 44, 2085-2091
-
(2010)
Environ. Sci. Technol.
, vol.44
, pp. 2085-2091
-
-
Bourg, I.1
Sposito, G.2
-
11
-
-
37049013294
-
Water diffusion in a synthetic hectorite clay studied by quasi-elastic neutron scattering
-
DOI 10.1021/jp0748009
-
Malikova, N.; Cadène, A.; Dubois, E.; Marry, V.; Durand-Vidal, S.; Turq, P.; Breu, J.; Longeville, S.; Zanotti, J.-M. Water diffusion in a synthetic hectorite clay studied by quasielastic neutron scattering J. Phys. Chem. C 2007, 111, 17603-17611 (Pubitemid 350247237)
-
(2007)
Journal of Physical Chemistry C
, vol.111
, Issue.47
, pp. 17603-17611
-
-
Malikova, N.1
Cadenea, A.2
Dubois, E.3
Marry, V.4
Durand-Vidal, S.5
Turq, P.6
Breu, J.7
Longeville, S.8
Zanotti, J.-M.9
-
12
-
-
12444252129
-
Hydration and swelling of synthetic Na-saponites: Infuence of layer charge
-
Michot, L.; Bihannic, I.; Pelletier, M.; Rinnert, E.; Robert, J. Hydration and swelling of synthetic Na-saponites: Infuence of layer charge Am. Mineral. 2005, 90, 166-172
-
(2005)
Am. Mineral.
, vol.90
, pp. 166-172
-
-
Michot, L.1
Bihannic, I.2
Pelletier, M.3
Rinnert, E.4
Robert, J.5
-
13
-
-
77949464471
-
Hydration properties and interlayer organization of water and ions in synthetic Na-smectite with tetrahedral layer charge. Part 1. Results from X-ray diffraction profle modeling
-
Ferrage, E.; Lanson, B.; Michot, L. J.; Robert, J.-L. Hydration properties and interlayer organization of water and ions in synthetic Na-smectite with tetrahedral layer charge. Part 1. Results from X-ray diffraction profle modeling J. Phys. Chem. C 2010, 114, 4515-4526
-
(2010)
J. Phys. Chem. C
, vol.114
, pp. 4515-4526
-
-
Ferrage, E.1
Lanson, B.2
Michot, L.J.3
Robert, J.-L.4
-
14
-
-
79953249104
-
-
Private communication.
-
Lanson, B. Private communication.
-
-
-
Lanson, B.1
-
15
-
-
0345898933
-
-
Springer Verlag: New York,; Vol.
-
Mezei, F. Lecture Notes in Physics; Springer Verlag: New York, 1980; Vol. 128.
-
(1980)
Lecture Notes in Physics
, vol.128
-
-
Mezei, F.1
-
16
-
-
34248567945
-
-
In ";;;, Eds.; Springer: New York,; pp - 354.
-
Lechner, R. E.; Longeville, S. In Quasielastic Neutron Scattering in Biology Part I: Methods in "Neutron Scattering in Biology, Techniques and Applications "; Fitter, J.; Gutberlet, T.; Katsaras., J., Eds.; Springer: New York, 2006; pp 309 - 354.
-
(2006)
Quasielastic Neutron Scattering in Biology Part I: Methods in "neutron Scattering in Biology, Techniques and Applications
, pp. 309
-
-
Lechner, R.E.1
Longeville, S.2
Fitter, J.3
Gutberlet, T.4
Katsaras, J.5
-
18
-
-
1242346370
-
The missing term in effective pair potentials
-
Berendsen, H.; Grigera, J.; Straatsma, T. The missing term in effective pair potentials J. Phys. Chem. 1987, 91, 6269-6271
-
(1987)
J. Phys. Chem.
, vol.91
, pp. 6269-6271
-
-
Berendsen, H.1
Grigera, J.2
Straatsma, T.3
-
19
-
-
0001324374
-
Solvent structure, dynamics, and ion mobility in aqueous solutions at 25 °C
-
Koneshan, S.; Rasaiah, C.; Lynden-Bell, R.; Lee, S. Solvent structure, dynamics, and ion mobility in aqueous solutions at 25 C J. Phys. Chem. B 1998, 102, 4193-4204 (Pubitemid 128578298)
-
(1998)
Journal of Physical Chemistry B
, vol.102
, Issue.21
, pp. 4193-4204
-
-
Koneshan, S.1
Rasaiah, J.C.2
Lynden-Bell, R.M.3
Lee, S.H.4
-
20
-
-
0024856961
-
Computer calculation of water clay interactions using atomic pair potentials
-
Skipper, N.; Refson, K.; McConnell, J. Computer calculation of water-clay interactions using atomic pair potentials Clay Miner. 1989, 24, 411-425 (Pubitemid 20607710)
-
(1989)
Clay Minerals
, vol.24
, Issue.2
, pp. 411-425
-
-
Skipper, N.T.1
Refson, K.2
McConnell, J.D.C.3
-
21
-
-
0026899334
-
Structure of liquids at a solid interface: An application to the swelling of clay by water
-
Delville, A. Structure of liquids at a solid interface: An application to the swelling of clay by water Langmuir 1992, 8, 1796-1805
-
(1992)
Langmuir
, vol.8
, pp. 1796-1805
-
-
Delville, A.1
-
22
-
-
0031078536
-
Molecular dynamics modeling of clay minerals. 1. gibbsite, kaolinite, pyrophyllite, and beidellite
-
Teppen, B.; Rasmussen, K.; Bertsch, P.; Miller, D.; Schafer, L. Molecular dynamics modeling of clay minerals. 1. Gibbsite, kaolinite, pyrophyllite, and beidellite J. Phys. Chem. B 1997, 101, 1579-1587 (Pubitemid 127628030)
-
(1997)
Journal of Physical Chemistry B
, vol.101
, Issue.9
, pp. 1579-1587
-
-
Teppen, B.J.1
Rasmussen, K.2
Bertsch, P.M.3
Miller, D.M.4
Schafer, L.5
-
23
-
-
0034299187
-
Vibrational spectra and structure of kaolinite: A computer simulation study
-
Bougeard, D.; Smirnov, K.; Geidel, E. Vibrational spectra and structure of kaolinite: A computer simulation study J. Phys. Chem. B 2000, 104, 9210-9217
-
(2000)
J. Phys. Chem. B
, vol.104
, pp. 9210-9217
-
-
Bougeard, D.1
Smirnov, K.2
Geidel, E.3
-
24
-
-
0032166964
-
Molecular computer simulations of the swelling properties and interlayer structure of cesium montmorillonite
-
Smith, D. Molecular computer simulations of the swelling properties and interlayer structure of cesium montmorillonite Langmuir 1998, 14, 5959-5967 (Pubitemid 128612913)
-
(1998)
Langmuir
, vol.14
, Issue.20
, pp. 5959-5967
-
-
Smith, D.E.1
-
25
-
-
0034915435
-
Modeling of diotahedral 2:1 phyllosilicates by means of transferable empirical potentials
-
DOI 10.1007/s002690000139
-
Sainz-Diaz, C.; Hernandez-Laguna, A.; Dove, M. Modeling of dioctahedral 2:1 phyllosilicates by means of transferable empirical potentials Phys. Chem. Miner. 2001, 28, 130-141 (Pubitemid 32682936)
-
(2001)
Physics and Chemistry of Minerals
, vol.28
, Issue.2
, pp. 130-141
-
-
Sainz-Diaz, C.I.1
Hernandez-Laguna, A.2
Dove, M.T.3
-
26
-
-
0442326619
-
Molecular models of hydroxide, oxyhydroxide, and clay phases and the development of a general force field
-
Cygan, R.; Liang, J.-J.; Kalinichev, A. Molecular models of hydroxide, oxyhydroxide, and clay phases and the development of a general force field J. Phys. Chem. B 2004, 108, 1255
-
(2004)
J. Phys. Chem. B
, vol.108
, pp. 1255
-
-
Cygan, R.1
Liang, J.-J.2
Kalinichev, A.3
-
27
-
-
28044444552
-
Force field for mica-type silicates and dynamics of octadecylammonium chains grafted to montmorillonite
-
DOI 10.1021/cm0509328
-
Heinz, H.; Koerner, H.; Anderson, K. L.; Vaia, R. A.; Farmer, B. Force field for mica-type silicates and dynamics of octadecylammonium chains grafted to montmorillonite Chem. Mater. 2005, 17, 5658-5669 (Pubitemid 41692219)
-
(2005)
Chemistry of Materials
, vol.17
, Issue.23
, pp. 5658-5669
-
-
Heinz, H.1
Koerner, H.2
Anderson, K.L.3
Vaia, R.A.4
Farmer, B.L.5
-
28
-
-
0029472780
-
Monte Carlo simulation of interlayer molecular structure in swelling clay minerals. 1. Methodology
-
Skipper, N.; Chang, F.-R.; Sposito, G. Monte Carlo simulation of interlayer molecular structure in swelling clay minerals. 1. Methodology Clays Clay Miner. 1995, 43, 285-293 (Pubitemid 26457135)
-
(1995)
Clays & Clay Minerals
, vol.43
, Issue.3
, pp. 285-293
-
-
Skipper, N.T.1
Fang-Ru Chou Chang2
Sposito, G.3
-
29
-
-
0037468541
-
Microscopic simulations of interlayer structure and dynamics in bihydrated heteroionic montmorillonites
-
Marry, V.; Turq, P. Microscopic simulations of interlayer structure and dynamics in bihydrated heteroionic montmorillonites J. Phys. Chem. B 2003, 107, 1832-1839
-
(2003)
J. Phys. Chem. B
, vol.107
, pp. 1832-1839
-
-
Marry, V.1
Turq, P.2
-
30
-
-
9244229518
-
Temperature effect in a montmorillonite clay at low hydration - Microscopic simulation
-
Malikova, N.; Marry, V.; Dufrêche, J.-F.; Simon, C.; Turq, P.; Giffaut, E. Temperature effect in a montmorillonite clay at low hydration-microscopic simulation Mol. Phys. 2004, 102, 1965-1977
-
(2004)
Mol. Phys.
, vol.102
, pp. 1965-1977
-
-
Malikova, N.1
Marry, V.2
Dufrêche, J.-F.3
Simon, C.4
Turq, P.5
Giffaut, E.6
-
31
-
-
35548996438
-
Water and ions in clays: Unraveling the interlayer/micropore exchange using molecular dynamics
-
Rotenberg, B.; Marry, V.; Vuilleumier, R.; Malikova, N.; Simon, C.; Turq, P. Water and ions in clays: Unraveling the interlayer/micropore exchange using molecular dynamics Geochim. Cosmochim. Acta 2007, 71, 5089
-
(2007)
Geochim. Cosmochim. Acta
, vol.71
, pp. 5089
-
-
Rotenberg, B.1
Marry, V.2
Vuilleumier, R.3
Malikova, N.4
Simon, C.5
Turq, P.6
-
32
-
-
49449101411
-
Structure and dynamics of water at a clay surface from molecular dynamics simulation
-
Marry, V.; Rotenberg, B.; Turq, P. Structure and dynamics of water at a clay surface from molecular dynamics simulation Phys. Chem. Chem. Phys. 2008, 10, 4802
-
(2008)
Phys. Chem. Chem. Phys.
, vol.10
, pp. 4802
-
-
Marry, V.1
Rotenberg, B.2
Turq, P.3
-
33
-
-
66149124514
-
On the driving force of cation exchange in clays: Insights from combined microcalorimetry experiments and molecular simulation
-
Rotenberg, B.; Morel, J.-P.; Marry, V.; Turq, P.; Morel-Desrosiers, N. On the driving force of cation exchange in clays: Insights from combined microcalorimetry experiments and molecular simulation Geochim. Cosmochim. Acta 2009, 73, 4034-4044
-
(2009)
Geochim. Cosmochim. Acta
, vol.73
, pp. 4034-4044
-
-
Rotenberg, B.1
Morel, J.-P.2
Marry, V.3
Turq, P.4
Morel-Desrosiers, N.5
-
34
-
-
61949220768
-
Adsorption isotherms of water on mica: Redistribution and film growth
-
Ateeque Malani, K. G. A. Adsorption isotherms of water on mica: Redistribution and film growth J. Phys. Chem. B 2009, 113, 1058-1067
-
(2009)
J. Phys. Chem. B
, vol.113
, pp. 1058-1067
-
-
Ateeque Malani, K.G.A.1
-
35
-
-
70349470977
-
Comparison of molecular dynamics simulations with triple layer and modifed Gouy-Chapman models in a 0.1 M NaCl montmorillonite system
-
Tournassat, C.; Chapron, Y.; Leroy, P.; Bizi, M.; Boulahya, F. Comparison of molecular dynamics simulations with triple layer and modifed Gouy-Chapman models in a 0.1 M NaCl montmorillonite system J. Colloid Interface Sci. 2009, 339, 533-541
-
(2009)
J. Colloid Interface Sci.
, vol.339
, pp. 533-541
-
-
Tournassat, C.1
Chapron, Y.2
Leroy, P.3
Bizi, M.4
Boulahya, F.5
-
36
-
-
67649880681
-
Simulation of water adsorption on kaolinite under atmospheric conditions
-
Croteau, T.; Bertram, A. K.; Patey, G. N. Simulation of water adsorption on kaolinite under atmospheric conditions J. Phys. Chem. A 2009, 113, 7826-7833
-
(2009)
J. Phys. Chem. A
, vol.113
, pp. 7826-7833
-
-
Croteau, T.1
Bertram, A.K.2
Patey, G.N.3
-
37
-
-
3042552030
-
Molecular simulations of swelling clay minerals
-
Tambach, T.; Hensen, E.; Smit, B. Molecular simulations of swelling clay minerals J. Phys. Chem. B 2004, 108, 7586-7596
-
(2004)
J. Phys. Chem. B
, vol.108
, pp. 7586-7596
-
-
Tambach, T.1
Hensen, E.2
Smit, B.3
-
38
-
-
33750305724
-
Molecular simulations of the pressure, temperature, and chemical potential dependencies of clay swelling
-
DOI 10.1021/jp062235o
-
Smith, D.; Wang, Y.; Chaturvedi, A.; Whitley, H. Molecular simulations of the pressure, temperature, and chemical potential dependencies of clay swelling J. Phys. Chem. B 2006, 110, 20046-20054 (Pubitemid 44626368)
-
(2006)
Journal of Physical Chemistry B
, vol.110
, Issue.40
, pp. 20046-20054
-
-
Smith, D.E.1
Wang, Y.2
Chaturvedi, A.3
Whitley, H.D.4
-
39
-
-
24944564626
-
Structure, energetics, and dynamics of water adsorbed on the muscovite (001) surface: A molecular dynamics simulation
-
DOI 10.1021/jp045299c
-
Wang, J.; Kalinichev, A.; Kirkpatrick, R.; Cygan, R. Structure, energetics, and dynamics of water adsorbed on the muscovite(001) surface: A molecular dynamics simulation J. Phys. Chem. B 2005, 109, 15893-15905 (Pubitemid 41321507)
-
(2005)
Journal of Physical Chemistry B
, vol.109
, Issue.33
, pp. 15893-15905
-
-
Wang, J.1
Kalinichev, A.G.2
Kirkpatrick, R.J.3
Cygan, R.T.4
-
40
-
-
33744913308
-
The structure and dynamics of 2-dimensional fluids in swelling clays
-
DOI 10.1016/j.chemgeo.2006.02.023, PII S0009254106001434
-
Skipper, N. T.; Lock, P. A.; Titiloye, J. O.; Swenson, J.; Mirza, Z. A.; Howells, W. S.; Fernandez-Alonso, F. The structure and dynamics of 2-dimensional fluids in swelling clays Chem. Geol. 2006, 230, 182-196 (Pubitemid 43842558)
-
(2006)
Chemical Geology
, vol.230
, Issue.3-4
, pp. 182-196
-
-
Skipper, N.T.1
Lock, P.A.2
Titiloye, J.O.3
Swenson, J.4
Mirza, Z.A.5
Howells, W.S.6
Fernandez-Alonso, F.7
-
41
-
-
0029472780
-
Monte Carlo simulation of interlayer molecular structure in swelling clay minerals. 1. Methodology
-
Skipper, N. T.; Chang, F.-R. C.; Sposito, G. Monte Carlo simulation of interlayer molecular structure in swelling clay minerals. 1. Methodology Clays Clay Miner. 1995, 43, 285
-
(1995)
Clays Clay Miner.
, vol.43
, pp. 285
-
-
Skipper, N.T.1
Chang, F.-R.C.2
Sposito, G.3
-
42
-
-
31344460392
-
Effects of substrate structure and composition on the structure, dynamics, and energetics of water at mineral surfaces: A molecular dynamics modeling study
-
DOI 10.1016/j.gca.2005.10.006, PII S0016703705008094
-
Wang, J.; Kalinichev, A.; Kirkpatrick, R. Effects of substrate structure and composition on the structure, dynamics, and energetics of water at mineral surfaces: A molecular dynamics modeling study Geochim. Cosmochim. Acta 2006, 70, 562-582 (Pubitemid 43135892)
-
(2006)
Geochimica et Cosmochimica Acta
, vol.70
, Issue.3
, pp. 562-582
-
-
Wang, J.1
Kalinichev, A.G.2
Kirkpatrick, R.J.3
-
43
-
-
0037242934
-
Fehlordnung bei smectiten in abhangigkeit vom zwischenschichtkation
-
DOI 10.1002/zaac.200390083
-
Breu, J.; Seidl, W.; Stoll, A. Disorder in smectites in dependence of the interlayer cation Z. Anorg. Allg. Chem. 2003, 629, 503-515 (Pubitemid 36384387)
-
(2003)
Zeitschrift fur Anorganische und Allgemeine Chemie
, vol.629
, Issue.3
, pp. 503-515
-
-
Breu, J.1
Seidl, W.2
Stoll, A.3
-
44
-
-
65249109324
-
Reinterpretation of the liquid water quasi-elastic neutron scattering spectra based on a nondiffusive jump reorientation mechanism
-
Laage, D. Reinterpretation of the liquid water quasi-elastic neutron scattering spectra based on a nondiffusive jump reorientation mechanism J. Phys. Chem. B 2009, 113, 2684-2687
-
(2009)
J. Phys. Chem. B
, vol.113
, pp. 2684-2687
-
-
Laage, D.1
-
45
-
-
58149260237
-
Signature of low-dimensional diffusion in complex systems
-
Malikova, N.; Longeville, S.; Zanotti, J.-M.; Dubois, E.; Marry, V.; Turq, P. Signature of low-dimensional diffusion in complex systems Phys. Rev. Lett. 2008, 101, 265901
-
(2008)
Phys. Rev. Lett.
, vol.101
, pp. 265901
-
-
Malikova, N.1
Longeville, S.2
Zanotti, J.-M.3
Dubois, E.4
Marry, V.5
Turq, P.6
-
46
-
-
0034666859
-
Temperature-dependent self-diffusion coeffcients of water and six selected molecular liquids for calibration in accurate 1H NMR PFG measurements
-
Holz, M.; Heil, S.; Sacco, A. Temperature-dependent self-diffusion coeffcients of water and six selected molecular liquids for calibration in accurate 1H NMR PFG measurements Phys. Chem. Chem. Phys. 2000, 2, 4740-4742
-
(2000)
Phys. Chem. Chem. Phys.
, vol.2
, pp. 4740-4742
-
-
Holz, M.1
Heil, S.2
Sacco, A.3
-
47
-
-
57049116557
-
On the molecular mechanism of water reorientation
-
Laage, D.; Hynes, J. T. On the molecular mechanism of water reorientation J. Phys. Chem. B 2008, 112, 14230-14242
-
(2008)
J. Phys. Chem. B
, vol.112
, pp. 14230-14242
-
-
Laage, D.1
Hynes, J.T.2
-
48
-
-
77149146180
-
Water hydrogen-bond dynamics around amino acids: The key role of hydrophilic hydrogen-bond acceptor groups
-
Sterpone, F.; Stirnemann, G.; Hynes, J. T.; Laage, D. Water hydrogen-bond dynamics around amino acids: The key role of hydrophilic hydrogen-bond acceptor groups J. Phys. Chem. B 2010, 114, 2083-2089
-
(2010)
J. Phys. Chem. B
, vol.114
, pp. 2083-2089
-
-
Sterpone, F.1
Stirnemann, G.2
Hynes, J.T.3
Laage, D.4
|