-
1
-
-
84896899391
-
-
The Millennium Development Goals Report, Technical Report, United Nations, 2010, URL: 〈〉.
-
The Millennium Development Goals Report, Technical Report, United Nations, 2010, URL: 〈〉. http://www.un.org/millenniumgoals/.
-
-
-
-
2
-
-
79961214184
-
The future of seawater desalination. energy, technology, and the environment
-
Elimelech M., Phillip W. The future of seawater desalination. energy, technology, and the environment. Science 2011, 333:712.
-
(2011)
Science
, vol.333
, pp. 712
-
-
Elimelech, M.1
Phillip, W.2
-
3
-
-
80051475088
-
Membrane engineering in process intensification. An overview
-
Drioli E., Stankiewicz A., Macedonio F. Membrane engineering in process intensification. An overview. J. Membr. Sci. 2011, 380:1.
-
(2011)
J. Membr. Sci.
, vol.380
, pp. 1
-
-
Drioli, E.1
Stankiewicz, A.2
Macedonio, F.3
-
4
-
-
0027337142
-
Composite reverse osmosis and nanofiltration membranes
-
Petersen R.J. Composite reverse osmosis and nanofiltration membranes. J. Membr. Sci. 1993, 83:81.
-
(1993)
J. Membr. Sci.
, vol.83
, pp. 81
-
-
Petersen, R.J.1
-
5
-
-
0031577969
-
Interfacially synthesized thin film composite RO membranes for seawater desalination
-
Prakash Rao A., Desai N.V., Rangarajan R. Interfacially synthesized thin film composite RO membranes for seawater desalination. J. Membr. Sci. 1997, 124:263.
-
(1997)
J. Membr. Sci.
, vol.124
, pp. 263
-
-
Prakash Rao, A.1
Desai, N.V.2
Rangarajan, R.3
-
6
-
-
64649091264
-
Effect of membrane chemistry and coating layer on physicochemical properties of thin film composite polyamide RO and NF membranes. I. FTIR and XPS characterization of polyamide and coating layer chemistry
-
Tang C.Y., Kwon Y.N., Leckie J.O. Effect of membrane chemistry and coating layer on physicochemical properties of thin film composite polyamide RO and NF membranes. I. FTIR and XPS characterization of polyamide and coating layer chemistry. Desalination 2009, 242:149.
-
(2009)
Desalination
, vol.242
, pp. 149
-
-
Tang, C.Y.1
Kwon, Y.N.2
Leckie, J.O.3
-
7
-
-
0027108569
-
Methods of generating dense relaxed amorphous polymer
-
McKechnie J., Brown D., Clarke J. Methods of generating dense relaxed amorphous polymer. Macromolecules 1992, 25:1562.
-
(1992)
Macromolecules
, vol.25
, pp. 1562
-
-
McKechnie, J.1
Brown, D.2
Clarke, J.3
-
8
-
-
7544219903
-
Atomistic simulation of the water influence on the local structure of polyamide 6,6
-
Goudeau S., Charlot M., Vergelati C., Müller-Plathe F. Atomistic simulation of the water influence on the local structure of polyamide 6,6. Macromolecules 2004, 37:8072.
-
(2004)
Macromolecules
, vol.37
, pp. 8072
-
-
Goudeau, S.1
Charlot, M.2
Vergelati, C.3
Müller-Plathe, F.4
-
9
-
-
44449178896
-
Molecular dynamics simulation study of water in amorphous kapton
-
Marque G., Neyertz S., Verdu J., Prunier V., Brown D. Molecular dynamics simulation study of water in amorphous kapton. Macromolecules 2008, 41:3349.
-
(2008)
Macromolecules
, vol.41
, pp. 3349
-
-
Marque, G.1
Neyertz, S.2
Verdu, J.3
Prunier, V.4
Brown, D.5
-
10
-
-
72649099614
-
Applications of positron annihilation spectroscopy and molecular dynamics simulations to aromatic polyamide pervaporation membranes
-
Kao S., Huang Y., Liao K., Hung W., Chang K., De Guzman M., Huang S., Wang D., Tung K., Lee K., Lai J. Applications of positron annihilation spectroscopy and molecular dynamics simulations to aromatic polyamide pervaporation membranes. J. Membr. Sci. 2010, 348:117.
-
(2010)
J. Membr. Sci.
, vol.348
, pp. 117
-
-
Kao, S.1
Huang, Y.2
Liao, K.3
Hung, W.4
Chang, K.5
De Guzman, M.6
Huang, S.7
Wang, D.8
Tung, K.9
Lee, K.10
Lai, J.11
-
11
-
-
77349124960
-
Molecular dynamics simulation of salt rejection in model surface-modified nanopores
-
Goldsmith J., Martens C.C. Molecular dynamics simulation of salt rejection in model surface-modified nanopores. J. Phys. Chem. Lett. 2010, 1:528.
-
(2010)
J. Phys. Chem. Lett.
, vol.1
, pp. 528
-
-
Goldsmith, J.1
Martens, C.C.2
-
12
-
-
77951729324
-
Ion-specific effects under confinement. the role of interfacial water
-
Argyris D., Cole D., Striolo A. Ion-specific effects under confinement. the role of interfacial water. ACS Nano 2010, 4:2035.
-
(2010)
ACS Nano
, vol.4
, pp. 2035
-
-
Argyris, D.1
Cole, D.2
Striolo, A.3
-
13
-
-
84896849321
-
-
Multiscale modelling of transfer mechanisms through nanofiltration membranes (Ph.D. thesis), University of Rennes
-
H.C. Zhu, Multiscale modelling of transfer mechanisms through nanofiltration membranes (Ph.D. thesis), University of Rennes, 2011.
-
(2011)
-
-
Zhu, H.C.1
-
14
-
-
84855974984
-
Aqueous NaCl and CsCl solutions confined in crystalline slit-shaped silica nanopores of varying degree of protonation
-
Ho T., Argyris D., Cole D., Striolo A. Aqueous NaCl and CsCl solutions confined in crystalline slit-shaped silica nanopores of varying degree of protonation. Langmuir 2012, 28:1256.
-
(2012)
Langmuir
, vol.28
, pp. 1256
-
-
Ho, T.1
Argyris, D.2
Cole, D.3
Striolo, A.4
-
15
-
-
84866134335
-
Anomalous dielectric behavior of nanoconfined electrolytic solutions
-
Zhu H., Ghoufi A., Szymczyk A., Balannec B., Morineau D. Anomalous dielectric behavior of nanoconfined electrolytic solutions. Phys. Rev. Lett. 2012, 109:107801.
-
(2012)
Phys. Rev. Lett.
, vol.109
, pp. 107801
-
-
Zhu, H.1
Ghoufi, A.2
Szymczyk, A.3
Balannec, B.4
Morineau, D.5
-
16
-
-
80054835189
-
Computer simulations of water flux and salt permeability of the reverse osmosis FT-30 aromatic polyamide membrane
-
Luo Y., Harder E., Faibish R.S., Roux B. Computer simulations of water flux and salt permeability of the reverse osmosis FT-30 aromatic polyamide membrane. J. Membr. Sci. 2011, 384:1.
-
(2011)
J. Membr. Sci.
, vol.384
, pp. 1
-
-
Luo, Y.1
Harder, E.2
Faibish, R.S.3
Roux, B.4
-
17
-
-
0032481437
-
Atomistic simulation of water and salt transport in the reverse osmosis membrane FT-30
-
Kotelyanskii M.J., Wagner N., Paulaitis M. Atomistic simulation of water and salt transport in the reverse osmosis membrane FT-30. J. Membr. Sci. 1998, 139:1.
-
(1998)
J. Membr. Sci.
, vol.139
, pp. 1
-
-
Kotelyanskii, M.J.1
Wagner, N.2
Paulaitis, M.3
-
18
-
-
0032826871
-
Molecular dynamics simulation study of the mechanisms of water diffusion in a hydrated, amorphous polyamide
-
Kotelyanskii M.J., Wagner N., Paulaitis M. Molecular dynamics simulation study of the mechanisms of water diffusion in a hydrated, amorphous polyamide. Comput. Theor. Polym. Sci. 1999, 9:301.
-
(1999)
Comput. Theor. Polym. Sci.
, vol.9
, pp. 301
-
-
Kotelyanskii, M.J.1
Wagner, N.2
Paulaitis, M.3
-
19
-
-
67651211717
-
Molecular dynamics study of a polymeric reverse osmosis membrane
-
Harder E., Walters D.E., Bodnar Y.D., Faibish R.S., Roux B. Molecular dynamics study of a polymeric reverse osmosis membrane. J. Phys. Chem. B. 2009, 113:10177.
-
(2009)
J. Phys. Chem. B.
, vol.113
, pp. 10177
-
-
Harder, E.1
Walters, D.E.2
Bodnar, Y.D.3
Faibish, R.S.4
Roux, B.5
-
20
-
-
78149425810
-
A computational investigation of the properties of a reverse osmosis membrane
-
Hughes Z.E., Gale J.D. A computational investigation of the properties of a reverse osmosis membrane. J. Mater. Chem. 2010, 20:7788.
-
(2010)
J. Mater. Chem.
, vol.20
, pp. 7788
-
-
Hughes, Z.E.1
Gale, J.D.2
-
21
-
-
33845372829
-
Probing the nano- and micro-scales of reverse osmosis membranes. a comprehensive characterization of physicochemical properties of uncoated and coated membranes by XPS, TEM, ATR-FTIR
-
Tang C.Y., Kwon Y.N., Leckie J.O. Probing the nano- and micro-scales of reverse osmosis membranes. a comprehensive characterization of physicochemical properties of uncoated and coated membranes by XPS, TEM, ATR-FTIR. J. Membr. Sci. 2007, 287:146.
-
(2007)
J. Membr. Sci.
, vol.287
, pp. 146
-
-
Tang, C.Y.1
Kwon, Y.N.2
Leckie, J.O.3
-
22
-
-
79956039782
-
Depth heterogeneity of fully aromatic polyamide active layers in reverse osmosis and nanofiltration membranes
-
Coronell O., Mariñas B.J., Cahill D.G. Depth heterogeneity of fully aromatic polyamide active layers in reverse osmosis and nanofiltration membranes. Environ. Sci. Technol. 2011, 45:4513.
-
(2011)
Environ. Sci. Technol.
, vol.45
, pp. 4513
-
-
Coronell, O.1
Mariñas, B.J.2
Cahill, D.G.3
-
23
-
-
84855928258
-
Degradation of polyamide nanofiltration and reverse osmosis membrane by hypochlorite
-
Do V.T., Tang C.Y., Reinhard M., Leckie J.O. Degradation of polyamide nanofiltration and reverse osmosis membrane by hypochlorite. Environ. Sci. Technol. 2012, 46:852.
-
(2012)
Environ. Sci. Technol.
, vol.46
, pp. 852
-
-
Do, V.T.1
Tang, C.Y.2
Reinhard, M.3
Leckie, J.O.4
-
24
-
-
33747761298
-
Physico-chemical characterization of NF/RO membrane active layers by Rutherford backscattering spectrometry
-
Mi B., Coronell O., Mariñas B., Watanabe F., Cahill D., Petrov I. Physico-chemical characterization of NF/RO membrane active layers by Rutherford backscattering spectrometry. J. Membr. Sci. 2006, 282:71-81.
-
(2006)
J. Membr. Sci.
, vol.282
, pp. 71-81
-
-
Mi, B.1
Coronell, O.2
Mariñas, B.3
Watanabe, F.4
Cahill, D.5
Petrov, I.6
-
25
-
-
84899638532
-
-
Molecular simulations of polyamide reverse osmosis membranes, Desalination. URL: 〈〉.
-
M. Ding, A. Ghoufi, A. Szymczyk, Molecular simulations of polyamide reverse osmosis membranes, Desalination. URL: 〈〉. http://dx.doi.org/10.1016/j.desal.2013.09.024.
-
-
-
Ding, M.1
Ghoufi, A.2
Szymczyk, A.3
-
26
-
-
0000821714
-
Detailed molecular structure of a vinyl polymer glass
-
Theodorou D.N., Suter U.W. Detailed molecular structure of a vinyl polymer glass. Macromolecules 1985, 18:1467.
-
(1985)
Macromolecules
, vol.18
, pp. 1467
-
-
Theodorou, D.N.1
Suter, U.W.2
-
27
-
-
84896820799
-
-
Material Studio is a Molecular Simulation Program from Distributed by Accelrys, Inc.
-
Material Studio is a Molecular Simulation Program from Distributed by Accelrys, Inc.
-
-
-
-
28
-
-
0001398008
-
How well does a restrained electrostatic potential (resp) model perform in calculating conformational energies of organic and biological molecules?
-
Wang J., Cieplak P., Kollman P.A. How well does a restrained electrostatic potential (resp) model perform in calculating conformational energies of organic and biological molecules?. J. Comput. Chem. 2000, 21:1049.
-
(2000)
J. Comput. Chem.
, vol.21
, pp. 1049
-
-
Wang, J.1
Cieplak, P.2
Kollman, P.A.3
-
29
-
-
0029011701
-
A second generation force field for the simulation of proteins, nucleic acids, and organic molecules
-
Cornell W.D., Cieplak P., Bayly C.I., Could I.R., Merz K.M., Ferguson D., Spellmeyer D., Fox T., Caldwell J.W., Kollman P.A. A second generation force field for the simulation of proteins, nucleic acids, and organic molecules. J. Am. Chem. Soc. 1996, 117:5179-5197.
-
(1996)
J. Am. Chem. Soc.
, vol.117
, pp. 5179-5197
-
-
Cornell, W.D.1
Cieplak, P.2
Bayly, C.I.3
Could, I.R.4
Merz, K.M.5
Ferguson, D.6
Spellmeyer, D.7
Fox, T.8
Caldwell, J.W.9
Kollman, P.A.10
-
30
-
-
29244471731
-
A general purpose model for the condensed phases of water. Tip4p/2005
-
Abascal J., Vega C. A general purpose model for the condensed phases of water. Tip4p/2005. J. Chem. Phys. 2005, 123:234505.
-
(2005)
J. Chem. Phys.
, vol.123
, pp. 234505
-
-
Abascal, J.1
Vega, C.2
-
32
-
-
84896877119
-
-
DLPOLY, CCP5 Program Library, Daresbury Lab
-
T.R. Forester, W. Smith, DLPOLY, CCP5 Program Library, Daresbury Lab., 2013.
-
(2013)
-
-
Forester, T.R.1
Smith, W.2
-
33
-
-
84925711387
-
Hoover NPT dynamics for systems varying in shape and size
-
Mechionna S., Ciccotti G., Holian B. Hoover NPT dynamics for systems varying in shape and size. Mol. Phys. 1993, 78:533.
-
(1993)
Mol. Phys.
, vol.78
, pp. 533
-
-
Mechionna, S.1
Ciccotti, G.2
Holian, B.3
-
34
-
-
33646940952
-
Numerical integration of the Cartesian equations of motion of a system with constraints. molecular dynamics of n-alkanes
-
Ryckaert J.-P., Ciccotti G., Berendsen H.J.C. Numerical integration of the Cartesian equations of motion of a system with constraints. molecular dynamics of n-alkanes. J. Comp. Phys. 1977, 23:327.
-
(1977)
J. Comp. Phys.
, vol.23
, pp. 327
-
-
Ryckaert, J.-P.1
Ciccotti, G.2
Berendsen, H.J.C.3
-
36
-
-
79951940149
-
Molecular simulations of confined liquids. an alternative to the grand canonical Monte Carlo simulations
-
Ghoufi A., Morineau D., Lefort R., Hureau I., Hennous L., Zhu H., Szymczyk A., Malfreyt P., Maurin G. Molecular simulations of confined liquids. an alternative to the grand canonical Monte Carlo simulations. J. Chem. Phys. 2011, 134:074104.
-
(2011)
J. Chem. Phys.
, vol.134
, pp. 074104
-
-
Ghoufi, A.1
Morineau, D.2
Lefort, R.3
Hureau, I.4
Hennous, L.5
Zhu, H.6
Szymczyk, A.7
Malfreyt, P.8
Maurin, G.9
-
37
-
-
33748580249
-
Fast method for computing pore size distributions of model materials
-
Bhattacharya S., Gubbins K.E. Fast method for computing pore size distributions of model materials. Langmuir 2006, 22(6):7726-7731.
-
(2006)
Langmuir
, vol.22
, Issue.6
, pp. 7726-7731
-
-
Bhattacharya, S.1
Gubbins, K.E.2
-
38
-
-
84865978830
-
Synchrotron SAXS to probe cross-linked network of polyamide 'reverse osmosis' and 'nanofiltration' membrane
-
Singh P.S., Ray P., Xie Z., Hoang M. Synchrotron SAXS to probe cross-linked network of polyamide 'reverse osmosis' and 'nanofiltration' membrane. J. Membr. Sci. 2012, 421:51.
-
(2012)
J. Membr. Sci.
, vol.421
, pp. 51
-
-
Singh, P.S.1
Ray, P.2
Xie, Z.3
Hoang, M.4
-
39
-
-
0037709893
-
Liquids in confined geometry. how to connect changes in the structure factor to modifications of local order
-
Morineau D., Alba-Simionesco C. Liquids in confined geometry. how to connect changes in the structure factor to modifications of local order. J. Chem. Phys. 2003, 118:9389.
-
(2003)
J. Chem. Phys.
, vol.118
, pp. 9389
-
-
Morineau, D.1
Alba-Simionesco, C.2
-
40
-
-
4243422452
-
Effect of environment on hydrogen bond dynamics in liquid water
-
Luzar A., Chandler D. Effect of environment on hydrogen bond dynamics in liquid water. Phys. Rev. Lett. 1996, 76:928-931.
-
(1996)
Phys. Rev. Lett.
, vol.76
, pp. 928-931
-
-
Luzar, A.1
Chandler, D.2
-
41
-
-
0035905815
-
Relationship between structural order and the anomalies of liquid water
-
Errington J.R., Debenedetti P.G. Relationship between structural order and the anomalies of liquid water. Nature 2001, 409:318.
-
(2001)
Nature
, vol.409
, pp. 318
-
-
Errington, J.R.1
Debenedetti, P.G.2
-
42
-
-
0000845322
-
Identifying clusters in computer experiments on systems of particles
-
Stoddard S. Identifying clusters in computer experiments on systems of particles. J. Comput. Phys. 1978, 27:291.
-
(1978)
J. Comput. Phys.
, vol.27
, pp. 291
-
-
Stoddard, S.1
-
43
-
-
80052587337
-
Hydrogen-bond-induced supermolecular assemblies in a nanoconfined tertiary
-
Ghoufi A., Hureau I., Morineau D., Lefort R. Hydrogen-bond-induced supermolecular assemblies in a nanoconfined tertiary. J. Phys. Chem. C 2011, 115:17761.
-
(2011)
J. Phys. Chem. C
, vol.115
, pp. 17761
-
-
Ghoufi, A.1
Hureau, I.2
Morineau, D.3
Lefort, R.4
-
44
-
-
24944544628
-
Partial structure factors from disordered materials diffraction data. an approach using empirical potential structure refinement
-
Soper A. Partial structure factors from disordered materials diffraction data. an approach using empirical potential structure refinement. Phys. Rev. B 2005, 72:104204.
-
(2005)
Phys. Rev. B
, vol.72
, pp. 104204
-
-
Soper, A.1
-
45
-
-
77954047502
-
The structure of ambient water
-
Clark G.N., Cappa C.D., Smith J.D., Saykally R.J., Head-Gordon T. The structure of ambient water. Mol. Phys. 2010, 108:1415.
-
(2010)
Mol. Phys.
, vol.108
, pp. 1415
-
-
Clark, G.N.1
Cappa, C.D.2
Smith, J.D.3
Saykally, R.J.4
Head-Gordon, T.5
-
46
-
-
0030401871
-
Building large amorphous polymer structures. atomistic simulation of glassy polystyrene
-
Kotelyanskii M.J., Wagner N., Paulaitis M. Building large amorphous polymer structures. atomistic simulation of glassy polystyrene. Macromolecules 1996, 29:8497.
-
(1996)
Macromolecules
, vol.29
, pp. 8497
-
-
Kotelyanskii, M.J.1
Wagner, N.2
Paulaitis, M.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.
-
(2008)
J. Phys. Chem. B
, vol.112
, pp. 14230
-
-
Laage, D.1
Hynes, J.-T.2
-
48
-
-
84884232284
-
Hydrated polyamide membrane and its interaction with alginate. a molecular dynamics study
-
Xiang Y., Liu Y., Mi B., Leng Y. Hydrated polyamide membrane and its interaction with alginate. a molecular dynamics study. Langmuir 2013, 29:11600.
-
(2013)
Langmuir
, vol.29
, pp. 11600
-
-
Xiang, Y.1
Liu, Y.2
Mi, B.3
Leng, Y.4
|