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119. Palmer BJ, Pfund DM, Fulton JL (1996) Direct modeling of EXAFS spectra from molecular
dynamics simulations. J Phys Chem 100:13393–13398. https://doi.org/10.1021/jp960160q
120. Zhang Z, Huang L, Wang Y, Yang K, Du Y, Wang Y, Kipper MJ, Belfiore LA, Tang J (2020)
Theory and simulation developments of confined mass transport through graphene-based
separation membranes. Phys Chem Chem Phys 22:6032–6057. https://doi.org/10.1039/c9c
p05551g
121. Millero FJ, Feistel R, Wright DG, McDougall TJ (2008) The composition of Standard
Seawater and the definition of the Reference-Composition Salinity Scale. Deep Sea Res Part
I 55:50–72. https://doi.org/10.1016/j.dsr.2007.10.001
122. Dervin S, Dionysiou DD, Pillai SC (2016) 2D nanostructures for water purification: graphene
and beyond. Nanoscale 8:15115–15131. https://doi.org/10.1039/c6nr04508a
123. Cohen-Tanugi D, Grossman JC (2014) Mechanical strength of nanoporous graphene as a
desalination membrane. Nano Lett 14:6171–6178. https://doi.org/10.1021/nl502399y
124. Mysels KJ (1960) Structure and Properties of Thin Films (Neugebauer, CA; Newkirk, JB;
Vermilyea, DA; eds.). ACS Publications. https://doi.org/10.1021/ed037pa822
125. Kovacs A, Kovács Á, Pogány M, Mescheder U (2007) Mechanical investigation of perforated
and porous membranes for micro-and nanofilter applications. Sens Actuat B: Chem 127:120–
125. https://doi.org/10.1016/j.snb.2007.07.044
126. Han T, Jiang T, Wang X, Li P, Qiao L, Zhang X (2019) Tuning the mechanical properties of
nanoporous graphene: a molecular dynamics study. Mater Res Express 6: https://doi.org/10.
1088/2053-1591/ab3331
127. Suk M, Aluru N (2013) Molecular and continuum hydrodynamics in graphene nanopores.
RSC Adv 3:9365–9372. https://doi.org/10.1039/c3ra40661j
128. Kim JY, Lee J-H, Grossman JC (2012) Thermal transport in functionalized graphene. ACS
Nano 6:9050–9057. https://doi.org/10.1021/nn3031595
129. Qin X, Yan W, Guo X, Gao T (2018) Effects of area, aspect ratio and orientation of rectangular
nanohole on the tensile strength of defective graphene–a molecular dynamics study. RSC Adv
8:17034–17043. https://doi.org/10.1039/c8ra02415d
130. Agius Anastasi A, Ritos K, Cassar G, Borg MK (2016) Mechanical properties of pristine and
nanoporous graphene. Mol Simul 42:1502–1511. https://doi.org/10.1080/08927022.2016.120
9753
131. Fang T-H, Lee Z-W, Chang W-J (2017) Molecular dynamics study of the shear strength and
fracture behavior of nanoporous graphene membranes. Curr Appl Phys 17:1323–1328. https://
doi.org/10.1016/j.cap.2017.07.003
132. Reina A, Jia X, Ho J, Nezich D, Son H, Bulovic V, Dresselhaus MS, Kong J (2009) Large
area, few-layer graphene films on arbitrary substrates by chemical vapor deposition. Nano
Lett 9:30–35. https://doi.org/10.1021/nl801827v
133. Buchheim J, Schlichting K-P, Wyss RM, Park HG (2018) Assessing the thickness-permeation
paradigm in nanoporous membranes. ACS Nano 13:134–142. https://doi.org/10.1021/acs
nano.8b04875
134. Zhang J, Chen C, Pan J, Zhang L, Liang L, Kong Z, Wang X, Zhang W, Shen J-W (2020)
Atomistic insights into the separation mechanism of multilayer graphene membranes for water
desalination. Phys Chem Chem Phys 22:7224–7233. https://doi.org/10.1039/d0cp00071j
135. Mooney D, Müller-Plathe F, Kremer K (1998) Simulation studies for liquid phenol: properties
evaluated and tested over a range of temperatures. Chem Phys Lett 294:135–142. https://doi.
org/10.1016/s0009-2614(98)00860-4
136. Abdol MA, Sadeghzadeh S, Jalaly M, Khatibi MM (2019) Constructing a three-dimensional
graphene structure via bonding layers by ion beam irradiation. Scientific Reports 9. https://
doi.org/10.1038/s41598-019-44697-z
137. Sahu S, Zwolak M (2019) Colloquium: Ionic phenomena in nanoscale pores through 2D
materials. Rev Mod Phys 91: https://doi.org/10.1103/revmodphys.91.021004
138. Sahu S, Zwolak M (2018) Maxwell-Hall access resistance in graphene nanopores. Phys Chem
Chem Phys 20:4646–4651. https://doi.org/10.1039/c7cp07924a
81
119. Palmer BJ, Pfund DM, Fulton JL (1996) Direct modeling of EXAFS spectra from molecular
dynamics simulations. J Phys Chem 100:13393–13398. https://doi.org/10.1021/jp960160q
120. Zhang Z, Huang L, Wang Y, Yang K, Du Y, Wang Y, Kipper MJ, Belfiore LA, Tang J (2020)
Theory and simulation developments of confined mass transport through graphene-based
separation membranes. Phys Chem Chem Phys 22:6032–6057. https://doi.org/10.1039/c9c
p05551g
121. Millero FJ, Feistel R, Wright DG, McDougall TJ (2008) The composition of Standard
Seawater and the definition of the Reference-Composition Salinity Scale. Deep Sea Res Part
I 55:50–72. https://doi.org/10.1016/j.dsr.2007.10.001
122. Dervin S, Dionysiou DD, Pillai SC (2016) 2D nanostructures for water purification: graphene
and beyond. Nanoscale 8:15115–15131. https://doi.org/10.1039/c6nr04508a
123. Cohen-Tanugi D, Grossman JC (2014) Mechanical strength of nanoporous graphene as a
desalination membrane. Nano Lett 14:6171–6178. https://doi.org/10.1021/nl502399y
124. Mysels KJ (1960) Structure and Properties of Thin Films (Neugebauer, CA; Newkirk, JB;
Vermilyea, DA; eds.). ACS Publications. https://doi.org/10.1021/ed037pa822
125. Kovacs A, Kovács Á, Pogány M, Mescheder U (2007) Mechanical investigation of perforated
and porous membranes for micro-and nanofilter applications. Sens Actuat B: Chem 127:120–
125. https://doi.org/10.1016/j.snb.2007.07.044
126. Han T, Jiang T, Wang X, Li P, Qiao L, Zhang X (2019) Tuning the mechanical properties of
nanoporous graphene: a molecular dynamics study. Mater Res Express 6: https://doi.org/10.
1088/2053-1591/ab3331
127. Suk M, Aluru N (2013) Molecular and continuum hydrodynamics in graphene nanopores.
RSC Adv 3:9365–9372. https://doi.org/10.1039/c3ra40661j
128. Kim JY, Lee J-H, Grossman JC (2012) Thermal transport in functionalized graphene. ACS
Nano 6:9050–9057. https://doi.org/10.1021/nn3031595
129. Qin X, Yan W, Guo X, Gao T (2018) Effects of area, aspect ratio and orientation of rectangular
nanohole on the tensile strength of defective graphene–a molecular dynamics study. RSC Adv
8:17034–17043. https://doi.org/10.1039/c8ra02415d
130. Agius Anastasi A, Ritos K, Cassar G, Borg MK (2016) Mechanical properties of pristine and
nanoporous graphene. Mol Simul 42:1502–1511. https://doi.org/10.1080/08927022.2016.120
9753
131. Fang T-H, Lee Z-W, Chang W-J (2017) Molecular dynamics study of the shear strength and
fracture behavior of nanoporous graphene membranes. Curr Appl Phys 17:1323–1328. https://
doi.org/10.1016/j.cap.2017.07.003
132. Reina A, Jia X, Ho J, Nezich D, Son H, Bulovic V, Dresselhaus MS, Kong J (2009) Large
area, few-layer graphene films on arbitrary substrates by chemical vapor deposition. Nano
Lett 9:30–35. https://doi.org/10.1021/nl801827v
133. Buchheim J, Schlichting K-P, Wyss RM, Park HG (2018) Assessing the thickness-permeation
paradigm in nanoporous membranes. ACS Nano 13:134–142. https://doi.org/10.1021/acs
nano.8b04875
134. Zhang J, Chen C, Pan J, Zhang L, Liang L, Kong Z, Wang X, Zhang W, Shen J-W (2020)
Atomistic insights into the separation mechanism of multilayer graphene membranes for water
desalination. Phys Chem Chem Phys 22:7224–7233. https://doi.org/10.1039/d0cp00071j
135. Mooney D, Müller-Plathe F, Kremer K (1998) Simulation studies for liquid phenol: properties
evaluated and tested over a range of temperatures. Chem Phys Lett 294:135–142. https://doi.
org/10.1016/s0009-2614(98)00860-4
136. Abdol MA, Sadeghzadeh S, Jalaly M, Khatibi MM (2019) Constructing a three-dimensional
graphene structure via bonding layers by ion beam irradiation. Scientific Reports 9. https://
doi.org/10.1038/s41598-019-44697-z
137. Sahu S, Zwolak M (2019) Colloquium: Ionic phenomena in nanoscale pores through 2D
materials. Rev Mod Phys 91: https://doi.org/10.1103/revmodphys.91.021004
138. Sahu S, Zwolak M (2018) Maxwell-Hall access resistance in graphene nanopores. Phys Chem
Chem Phys 20:4646–4651. https://doi.org/10.1039/c7cp07924a
