-
1
-
-
84873368790
-
What is the Contact Angle of Water on Graphene?
-
Taherian, F.; Marcon, V.; van der Vegt, N. F. A.; Leroy, F. What is the Contact Angle of Water on Graphene? Langmuir 2013, 29, 1457-1465
-
(2013)
Langmuir
, vol.29
, pp. 1457-1465
-
-
Taherian, F.1
Marcon, V.2
Van Der Vegt, N.F.A.3
Leroy, F.4
-
2
-
-
70349932965
-
Interfacial Water at Hydrophobic and Hydrophilic Surfaces: Slip, Viscosity, and Diffusion
-
Sendner, C.; Horinek, D.; Bocquet, L.; Netz, R. R. Interfacial Water at Hydrophobic and Hydrophilic Surfaces: Slip, Viscosity, And Diffusion Langmuir 2009, 25, 10768-10781
-
(2009)
Langmuir
, vol.25
, pp. 10768-10781
-
-
Sendner, C.1
Horinek, D.2
Bocquet, L.3
Netz, R.R.4
-
3
-
-
67649959961
-
Water at Polar and Nonpolar Solid Walls (Review)
-
Sedlmeier, F.; Janecek, J.; Sendner, C. B., L.; Netz, R. R.; Horinek, D. Water at Polar and Nonpolar Solid Walls (Review) Biointerphases 2008, 3, Fc23-Fc39
-
(2008)
Biointerphases
, vol.3
-
-
Sedlmeier, F.1
Janecek, J.2
Sendner, C.B..L.3
Netz, R.R.4
Horinek, D.5
-
4
-
-
84868021547
-
Breakdown in the Wetting Transparency of Graphene
-
Shih, C. J.; Wang, Q. H.; Lin, S.; Park, K. C.; Jin, Z.; Strano, M. S.; Blankschtein, D. Breakdown in the Wetting Transparency of Graphene Phys. Rev. Lett. 2012, 109, 176101-176106
-
(2012)
Phys. Rev. Lett.
, vol.109
, pp. 176101-176106
-
-
Shih, C.J.1
Wang, Q.H.2
Lin, S.3
Park, K.C.4
Jin, Z.5
Strano, M.S.6
Blankschtein, D.7
-
5
-
-
84870897322
-
On Interfacial Tension at a Rigid Apolar Wall-Water Interface
-
Machlin, E. S. On Interfacial Tension at a Rigid Apolar Wall-Water Interface Langmuir 2012, 28, 16729-16732
-
(2012)
Langmuir
, vol.28
, pp. 16729-16732
-
-
MacHlin, E.S.1
-
6
-
-
49149096826
-
Validity of the "sharp-Kink Approximation" for Water and Other Fluids
-
Garcia, R.; Osborne, K.; Subashi, E. Validity of the "Sharp-Kink Approximation" for Water and Other Fluids J. Phys. Chem. B 2008, 112, 8114-8119
-
(2008)
J. Phys. Chem. B
, vol.112
, pp. 8114-8119
-
-
Garcia, R.1
Osborne, K.2
Subashi, E.3
-
7
-
-
0001786512
-
-
Domb, C. Lebowitz, J. L. Academic Press: London, Vol.
-
Dietrich, S. In Phase Transitions and Critical Phenomena; Domb, C.; Lebowitz, J. L., Eds.; Academic Press: London, 1988; Vol. 12, p 1.
-
(1988)
Phase Transitions and Critical Phenomena
, vol.12
, pp. 1
-
-
Dietrich, S.1
-
8
-
-
4143089970
-
Analytic Results for Wetting Transitions in the Presence of van der Waals Tails
-
Dietrich, S.; Napiórkowski, M. Analytic Results for Wetting Transitions in the Presence of van der Waals Tails Phys. Rev. A 1991, 43, 1861-1885
-
(1991)
Phys. Rev. A
, vol.43
, pp. 1861-1885
-
-
Dietrich, S.1
Napiórkowski, M.2
-
9
-
-
25544466058
-
Order of Wetting Transitions
-
Dietrich, S.; Schick, M. Order of Wetting Transitions Phys. Rev. B 1986, 33, 4952-4968
-
(1986)
Phys. Rev. B
, vol.33
, pp. 4952-4968
-
-
Dietrich, S.1
Schick, M.2
-
10
-
-
79959486658
-
Hydrophobicity of Proteins and Interfaces: Insights from Density Fluctuations
-
Jamadagni, S. N.; Godawat, R.; Garde, S. Hydrophobicity of Proteins and Interfaces: Insights from Density Fluctuations Annu. Rev. Chem. Biomol. Eng. 2011, 2, 147-171
-
(2011)
Annu. Rev. Chem. Biomol. Eng.
, vol.2
, pp. 147-171
-
-
Jamadagni, S.N.1
Godawat, R.2
Garde, S.3
-
11
-
-
70349339280
-
Characterizing Hydrophobicity of Interfaces by Using Cavity Formation, Solute Binding, and Water Correlations
-
Godawat, R.; Jamadagni, S. N.; Garde, S. Characterizing Hydrophobicity of Interfaces by Using Cavity Formation, Solute Binding, and Water Correlations Proc. Natl. Acad. Sci. U.S.A. 2009, 106, 15119-15124
-
(2009)
Proc. Natl. Acad. Sci. U.S.A.
, vol.106
, pp. 15119-15124
-
-
Godawat, R.1
Jamadagni, S.N.2
Garde, S.3
-
12
-
-
80053649541
-
Extended Surfaces Modulate Hydrophobic Interactions of Neighboring Solutes
-
Patel, A. J.; Varilly, P.; Jamadagni, S. N.; Acharya, H.; Garde, S.; Chandler, D. Extended Surfaces Modulate Hydrophobic Interactions of Neighboring Solutes Proc. Natl. Acad. Sci. U.S.A. 2011, 108, 17678-17683
-
(2011)
Proc. Natl. Acad. Sci. U.S.A.
, vol.108
, pp. 17678-17683
-
-
Patel, A.J.1
Varilly, P.2
Jamadagni, S.N.3
Acharya, H.4
Garde, S.5
Chandler, D.6
-
13
-
-
1242346370
-
The Missing Term in Effective Pair Potentials
-
Berendsen, H. J. C.; Grigera, J. R.; Straatsma, T. P. 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.J.C.1
Grigera, J.R.2
Straatsma, T.P.3
-
14
-
-
84986440341
-
SETTLE: An Analytical Version of the SHAKE and RATTLE Algorithms for Rigid Water Models
-
Miyamoto, S.; Kollman, P. A. SETTLE: An Analytical Version of the SHAKE and RATTLE Algorithms for Rigid Water Models J. Comput. Chem. 1992, 13, 952-962
-
(1992)
J. Comput. Chem.
, vol.13
, pp. 952-962
-
-
Miyamoto, S.1
Kollman, P.A.2
-
15
-
-
46249092554
-
GROMACS 4: Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation
-
Hess, B.; Kutzner, C.; Spoel, D. V. D.; Lindahl, E. GROMACS 4: Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation J. Chem. Theory Comput. 2008, 4, 435-447
-
(2008)
J. Chem. Theory Comput.
, vol.4
, pp. 435-447
-
-
Hess, B.1
Kutzner, C.2
Spoel, D.V.D.3
Lindahl, E.4
-
16
-
-
33645961739
-
A Smooth Particle Mesh Ewald Method
-
Essmann, U.; Perera, L.; Berkowitz, M. L.; Darden, T.; Lee, H.; Pedersen, L. G. A Smooth Particle Mesh Ewald Method J. Chem. Phys. 1995, 103, 8577-8593
-
(1995)
J. Chem. Phys.
, vol.103
, pp. 8577-8593
-
-
Essmann, U.1
Perera, L.2
Berkowitz, M.L.3
Darden, T.4
Lee, H.5
Pedersen, L.G.6
-
17
-
-
0037434746
-
On the Water-Carbon Interaction for Use in Molecular Dynamics Simulations of Graphite and Carbon Nanotubes
-
Werder, T.; Walther, J. H.; Jaffe, R. L.; Halicioglu, T.; Koumoutsakos, P. On the Water-Carbon Interaction for Use in Molecular Dynamics Simulations of Graphite and Carbon Nanotubes J. Phys. Chem. B 2003, 107, 1345-1352
-
(2003)
J. Phys. Chem. B
, vol.107
, pp. 1345-1352
-
-
Werder, T.1
Walther, J.H.2
Jaffe, R.L.3
Halicioglu, T.4
Koumoutsakos, P.5
-
18
-
-
84943502952
-
A Molecular Dynamics Method for Simulations in the Canonical Ensemble
-
Nose, S. A Molecular Dynamics Method for Simulations in the Canonical Ensemble Mol. Phys. 1984, 52, 255-268
-
(1984)
Mol. Phys.
, vol.52
, pp. 255-268
-
-
Nose, S.1
-
19
-
-
0001538909
-
Canonical Dynamics: Equilibrium Phase-Space Distributions
-
Hoover, W. G. Canonical Dynamics: Equilibrium Phase-Space Distributions Phys. Rev. A 1985, 31, 1695-1697
-
(1985)
Phys. Rev. A
, vol.31
, pp. 1695-1697
-
-
Hoover, W.G.1
-
20
-
-
84857276468
-
Wetting Transparency of Graphene
-
Rafiee, J.; Mi, X.; Gullapalli, H.; Thomas, A. V.; Yavari, F.; Shi, Y.; Ajayan, P. M.; Koratkar, N. A. Wetting Transparency of Graphene Nat. Mater. 2012, 11, 217-222
-
(2012)
Nat. Mater.
, vol.11
, pp. 217-222
-
-
Rafiee, J.1
Mi, X.2
Gullapalli, H.3
Thomas, A.V.4
Yavari, F.5
Shi, Y.6
Ajayan, P.M.7
Koratkar, N.A.8
-
21
-
-
36849103820
-
Role of Repulsive Forces in Determining Equilibrium Structure of Simple Liquids
-
Weeks, J. D.; Chandler, D.; Andersen, H. C. Role of Repulsive Forces in Determining Equilibrium Structure of Simple Liquids J. Chem. Phys. 1971, 54, 5237-5247
-
(1971)
J. Chem. Phys.
, vol.54
, pp. 5237-5247
-
-
Weeks, J.D.1
Chandler, D.2
Andersen, H.C.3
-
22
-
-
78651337712
-
Rationalization of the Behavior of Solid-Liquid Surface Free Energy of Water in Cassie and Wenzel Wetting States on Rugged Solid Surfaces at the Nanometer Scale
-
Leroy, F.; Müller-Plathe, F. Rationalization of the Behavior of Solid-Liquid Surface Free Energy of Water in Cassie and Wenzel Wetting States on Rugged Solid Surfaces at the Nanometer Scale Langmuir 2011, 27, 637-645
-
(2011)
Langmuir
, vol.27
, pp. 637-645
-
-
Leroy, F.1
Müller-Plathe, F.2
-
23
-
-
0035913519
-
Scaling of Hydrophobic Solvation Free Energies
-
Huang, D. M.; Geissler, P. L.; Chandler, D. Scaling of Hydrophobic Solvation Free Energies J. Phys. Chem. B 2001, 105, 6704-6709
-
(2001)
J. Phys. Chem. B
, vol.105
, pp. 6704-6709
-
-
Huang, D.M.1
Geissler, P.L.2
Chandler, D.3
-
24
-
-
36849122972
-
High-Temperature Equation of State by a Perturbation Method. I. Nonpolar Gases
-
Zwanzig, R. W. High-Temperature Equation of State by a Perturbation Method. I. Nonpolar Gases J. Chem. Phys. 1954, 22, 1420-1427
-
(1954)
J. Chem. Phys.
, vol.22
, pp. 1420-1427
-
-
Zwanzig, R.W.1
-
25
-
-
0012011409
-
Configurational Properties and Corresponding States in Simple Fluids and Water
-
Sanchez, I. C.; Truskett, T. M.; In't Veld, P. J. Configurational Properties and Corresponding States in Simple Fluids and Water J. Phys. Chem. B 1999, 103, 5106-5116
-
(1999)
J. Phys. Chem. B
, vol.103
, pp. 5106-5116
-
-
Sanchez, I.C.1
Truskett, T.M.2
In'T Veld, P.J.3
-
26
-
-
2442610396
-
Energy-Entropy Compensation in the Transfer of Nonpolar Solutes from Water to Co-Solvent/Water Mixtures
-
van der Vegt, N. F. A.; Trzesniak, D.; Kasumaj, B.; van Gunsteren, W. F. Energy-Entropy Compensation in the Transfer of Nonpolar Solutes from Water to Co-Solvent/Water Mixtures ChemPhysChem 2004, 5, 144-147
-
(2004)
ChemPhysChem
, vol.5
, pp. 144-147
-
-
Van Der Vegt, N.F.A.1
Trzesniak, D.2
Kasumaj, B.3
Van Gunsteren, W.F.4
-
27
-
-
24944555363
-
From Hydrophobic to Hydrophilic Solvation: An Application to Hydration of Benzene
-
Schravendijk, P.; van der Vegt, N. F. A. From Hydrophobic to Hydrophilic Solvation: An Application to Hydration of Benzene J. Chem. Theory Comput. 2005, 1, 643-652
-
(2005)
J. Chem. Theory Comput.
, vol.1
, pp. 643-652
-
-
Schravendijk, P.1
Van Der Vegt, N.F.A.2
-
28
-
-
33645888963
-
A Simple Model for Demonstrating the Relation between Solubility, Hydrophobic Interaction and Structural Changes in the Solvent
-
Ben-Naim, A. A Simple Model for Demonstrating the Relation between Solubility, Hydrophobic Interaction and Structural Changes in the Solvent J. Chem. Phys. 1978, 82, 874-885
-
(1978)
J. Chem. Phys.
, vol.82
, pp. 874-885
-
-
Ben-Naim, A.1
-
29
-
-
36549101599
-
A Thermodynamic Analysis of Solvation
-
Yu, H. A.; Karplus, M. A Thermodynamic Analysis of Solvation J. Chem. Phys. 1988, 89, 2366-2379
-
(1988)
J. Chem. Phys.
, vol.89
, pp. 2366-2379
-
-
Yu, H.A.1
Karplus, M.2
-
30
-
-
34547475679
-
Solvent Reorganization Contributions in Solute Transfer Thermodynamics: Inferences from the Solvent Equation of State
-
Peter, C.; van der Vegt, N. F. A. Solvent Reorganization Contributions in Solute Transfer Thermodynamics: Inferences from the Solvent Equation of State J. Phys. Chem. B 2007, 111, 7836-7842
-
(2007)
J. Phys. Chem. B
, vol.111
, pp. 7836-7842
-
-
Peter, C.1
Van Der Vegt, N.F.A.2
-
31
-
-
51649088169
-
Unraveling Water's Entropic Mysteries: A Unified View of Nonpolar, Polar, and Ionic Hydration
-
Ben-Amotz, D.; Underwood, R. Unraveling Water's Entropic Mysteries: A Unified View of Nonpolar, Polar, and Ionic Hydration Acc. Chem. Res. 2008, 41, 957-967
-
(2008)
Acc. Chem. Res.
, vol.41
, pp. 957-967
-
-
Ben-Amotz, D.1
Underwood, R.2
-
32
-
-
0030134110
-
On the Validity of Electrostatic Linear Response in Polar Solvents
-
Åqvist, J.; Hansson, T. On the Validity of Electrostatic Linear Response in Polar Solvents J. Phys. Chem. 1996, 100, 9512-9521
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 9512-9521
-
-
Åqvist, J.1
Hansson, T.2
|