Aqueous proton transfer across single-layer graphene

Achtyl, Jennifer L.; Unocic, Raymond R.; Xu, Lijun; Cai, Yu; Raju, Muralikrishna; Zhang, Weiwei; Sacci, Robert L.; Vlassiouk, Ivan V.; Fulvio, Pasquale F.; Ganesh, Panchapakesan; Wesolowski, David J.; Dai, Sheng; van Duin, Adri C.  T.; Neurock, Matthew; Geiger, Franz M.

doi:10.1038/ncomms7539

Title: Aqueous proton transfer across single-layer graphene

Journal Article · Tue Mar 17 00:00:00 EDT 2015 · Nature Communications

DOI:https://doi.org/10.1038/ncomms7539· OSTI ID:1210480

Achtyl, Jennifer L. ^[1]; Unocic, Raymond R. ^[2]; Xu, Lijun ^[3]; Cai, Yu ^[3]; Raju, Muralikrishna ^[4]; Zhang, Weiwei ^[4]; Sacci, Robert L. ^[5]; Vlassiouk, Ivan V. ^[6]; Fulvio, Pasquale F. ^[7]; Ganesh, Panchapakesan ^[2]; Wesolowski, David J. ^[8]; Dai, Sheng ^[8]; van Duin, Adri C. T. ^[4]; Neurock, Matthew ^[9]; Geiger, Franz M. ^[1]

Northwestern Univ., Evanston, IL (United States)
Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States). Center for Nanophase Materials Science (CNMS)
Univ. of Virginia, Charlottesville, VA (United States)
Pennsylvania State Univ., University Park, PA (United States)
Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States). Measurement Science and Systems Engineering Division
Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States). Measurement Science and Systems Engineering Division
Univ. of Puerto Rico, San Juan (Puerto Rico); Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States). Chemical Sciences Division
Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States). Chemical Sciences Division
Univ. of Virginia, Charlottesville, VA (United States); Univ. of Minnesota, Minneapolis, MN (United States)

Proton transfer across single-layer graphene proceeds with large computed energy barriers and is therefore thought to be unfavourable at room temperature unless nanoscale holes or dopants are introduced, or a potential bias is applied. In this paper, we subject single-layer graphene supported on fused silica to cycles of high and low pH, and show that protons transfer reversibly from the aqueous phase through the graphene to the other side where they undergo acid–base chemistry with the silica hydroxyl groups. After ruling out diffusion through macroscopic pinholes, the protons are found to transfer through rare, naturally occurring atomic defects. Computer simulations reveal low energy barriers of 0.61–0.75 eV for aqueous proton transfer across hydroxyl-terminated atomic defects that participate in a Grotthuss-type relay, while pyrylium-like ether terminations shut down proton exchange. Finally, unfavourable energy barriers to helium and hydrogen transfer indicate the process is selective for aqueous protons.

View Accepted Manuscript (DOE)

Cite

Export

Save

Research Organization:: Energy Frontier Research Centers (EFRC). Fluid Interface Reactions, Structures and Transport Center (FIRST); Energy Frontier Research Centers (EFRC) (United States). Fluid Interface Reactions, Structures and Transport Center (FIRST); Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES)

Grant/Contract Number:: ERKCC61; AC05-00OR22725

OSTI ID:: 1210480

Alternate ID(s):: OSTI ID: 1265424

Journal Information:: Nature Communications, Vol. 6; ISSN 2041-1723

Publisher:: Nature Publishing GroupCopyright Statement

Country of Publication:: United States

Language:: English

Citation Metrics:

Cited by: 184 works

Citation information provided by
Web of Science

References (73)

Generalized Gradient Approximation Made Simple Perdew, John P.; Burke, Kieron; Ernzerhof, Matthias Physical Review Letters, Vol. 77, Issue 18, p. 3865-3868 https://doi.org/10.1103/PhysRevLett.77.3865	journal	October 1996
Graphene-Based Environmental Barriers Guo, Fei; Silverberg, Gregory; Bowers, Shin Environmental Science & Technology, Vol. 46, Issue 14 https://doi.org/10.1021/es301377y	journal	July 2012
Rapid long-range proton diffusion along the surface of the purple membrane and delayed proton transfer into the bulk. Alexiev, U.; Mollaaghababa, R.; Scherrer, P. Proceedings of the National Academy of Sciences, Vol. 92, Issue 2 https://doi.org/10.1073/pnas.92.2.372	journal	January 1995
Graphene Oxide Membranes for Ionic and Molecular Sieving Mi, B. Science, Vol. 343, Issue 6172 https://doi.org/10.1126/science.1250247	journal	February 2014
Why Are Water−Hydrophobic Interfaces Charged? Kudin, Konstantin N.; Car, Roberto Journal of the American Chemical Society, Vol. 130, Issue 12 https://doi.org/10.1021/ja077205t	journal	March 2008
Cover Picture: Recoding the Genetic Code with Selenocysteine (Angew. Chem. Int. Ed. 1/2014) Bröcker, Markus J.; Ho, Joanne M. L.; Church, George M. Angewandte Chemie International Edition, Vol. 53, Issue 1 https://doi.org/10.1002/anie.201310509	journal	December 2013
Graphene Reknits Its Holes Zan, Recep; Ramasse, Quentin M.; Bangert, Ursel Nano Letters, Vol. 12, Issue 8 https://doi.org/10.1021/nl300985q	journal	July 2012
Evidence of the Existence of Three Types of Species at the Quartz−Aqueous Solution Interface at pH 0−10: XPS Surface Group Quantification and Surface Complexation Modeling Duval, Y.; Mielczarski, J. A.; Pokrovsky, O. S. The Journal of Physical Chemistry B, Vol. 106, Issue 11 https://doi.org/10.1021/jp012818s	journal	March 2002
Proton transport through one-atom-thick crystals Hu, S.; Lozada-Hidalgo, M.; Wang, F. C. Nature, Vol. 516, Issue 7530 https://doi.org/10.1038/nature14015	journal	November 2014
Protons migrate along interfacial water without significant contributions from jumps between ionizable groups on the membrane surface Springer, A.; Hagen, V.; Cherepanov, D. A. Proceedings of the National Academy of Sciences, Vol. 108, Issue 35 https://doi.org/10.1073/pnas.1107476108	journal	August 2011
Specific Cation Effects on the Bimodal Acid–Base Behavior of the Silica/Water Interface Azam, Md. Shafiul; Weeraman, Champika N.; Gibbs-Davis, Julianne M. The Journal of Physical Chemistry Letters, Vol. 3, Issue 10 https://doi.org/10.1021/jz300255x	journal	April 2012
Mechanisms of Proton Conductance in Polymer Electrolyte Membranes Eikerling, M.; Kornyshev, A. A.; Kuznetsov, A. M. The Journal of Physical Chemistry B, Vol. 105, Issue 17 https://doi.org/10.1021/jp003182s	journal	May 2001
Interaction of Chromium(VI) with the α-Aluminum Oxide−Water Interface Musorrafiti, Michael J.; Konek, Christopher T.; Hayes, Patrick L. The Journal of Physical Chemistry C, Vol. 112, Issue 6 https://doi.org/10.1021/jp076739d	journal	February 2008
Jammed Acid−Base Reactions at Interfaces Gibbs-Davis, Julianne M.; Kruk, Jennifer J.; Konek, Christopher T. Journal of the American Chemical Society, Vol. 130, Issue 46 https://doi.org/10.1021/ja804302s	journal	November 2008
Proton migration along the membrane surface and retarded surface to bulk transfer Heberle, Joachim; Riesle, Jens; Thiedemann, Gerd Nature, Vol. 370, Issue 6488 https://doi.org/10.1038/370379a0	journal	August 1994
Hydrated Excess Proton at Water−Hydrophobic Interfaces ^† Iuchi, Satoru; Chen, Hanning; Paesani, Francesco The Journal of Physical Chemistry B, Vol. 113, Issue 13 https://doi.org/10.1021/jp805304j	journal	April 2009
Crown ethers in graphene Guo, Junjie; Lee, Jaekwang; Contescu, Cristian I. Nature Communications, Vol. 5, Issue 1 https://doi.org/10.1038/ncomms6389	journal	November 2014
Acoustic waves in finite superlattices: Influence of buffer layers Hammouchi, M.; El Boudouti, E. H.; Nougaoui, A. Physical Review B, Vol. 59, Issue 3 https://doi.org/10.1103/PhysRevB.59.1999	journal	January 1999
First principles study of the permeability of graphene to hydrogen atoms Miao, Meng; Nardelli, Marco Buongiorno; Wang, Qi Physical Chemistry Chemical Physics, Vol. 15, Issue 38 https://doi.org/10.1039/c3cp52318g	journal	January 2013
Interactions of Organic Solvents at Graphene/α-Al ₂ O ₃ and Graphene Oxide/α-Al ₂ O ₃ Interfaces Studied by Sum Frequency Generation Achtyl, Jennifer L.; Vlassiouk, Ivan V.; Dai, Sheng The Journal of Physical Chemistry C, Vol. 118, Issue 31 https://doi.org/10.1021/jp5047547	journal	July 2014
The role of fixed and mobile buffers in the kinetics of proton movement Junge, Wolfgang; McLaughlin, Stuart Biochimica et Biophysica Acta (BBA) - Bioenergetics, Vol. 890, Issue 1 https://doi.org/10.1016/0005-2728(87)90061-2	journal	January 1987
Grains and grain boundaries in single-layer graphene atomic patchwork quilts Huang, Pinshane Y.; Ruiz-Vargas, Carlos S.; van der Zande, Arend M. Nature, Vol. 469, Issue 7330, p. 389-392 https://doi.org/10.1038/nature09718	journal	January 2011
Unimpeded Permeation of Water Through Helium-Leak-Tight Graphene-Based Membranes Nair, R. R.; Wu, H. A.; Jayaram, P. N. Science, Vol. 335, Issue 6067, p. 442-444 https://doi.org/10.1126/science.1211694	journal	January 2012
Thermodynamics and Proton Transport in Nafion Choi, Pyoungho; Jalani, Nikhil H.; Datta, Ravindra Journal of The Electrochemical Society, Vol. 152, Issue 3 https://doi.org/10.1149/1.1859814	journal	January 2005
Environmental Biogeochemistry Studied by Second-Harmonic Generation: A Look at the Agricultural Antibiotic Oxytetracycline ^† Hayes, Patrick L.; Gibbs-Davis, Julianne M.; Musorrafiti, Michael J. The Journal of Physical Chemistry C, Vol. 111, Issue 25 https://doi.org/10.1021/jp0672149	journal	June 2007
Water at hydrophobic interfaces delays proton surface-to-bulk transfer and provides a pathway for lateral proton diffusion Zhang, C.; Knyazev, D. G.; Vereshaga, Y. A. Proceedings of the National Academy of Sciences, Vol. 109, Issue 25 https://doi.org/10.1073/pnas.1121227109	journal	June 2012
Vacancy clusters as entry ports for cesium intercalation in graphite Büttner, Michael; Choudhury, Pabitra; Karl Johnson, J. Carbon, Vol. 49, Issue 12 https://doi.org/10.1016/j.carbon.2011.05.032	journal	October 2011
Nanoporous Graphene Membranes for Efficient ³ He/ ⁴ He Separation Hauser, Andreas W.; Schwerdtfeger, Peter The Journal of Physical Chemistry Letters, Vol. 3, Issue 2 https://doi.org/10.1021/jz201504k	journal	January 2012
Graphene Nucleation Density on Copper: Fundamental Role of Background Pressure Vlassiouk, Ivan; Smirnov, Sergei; Regmi, Murari The Journal of Physical Chemistry C, Vol. 117, Issue 37 https://doi.org/10.1021/jp4047648	journal	September 2013
Scanning electrochemical microscopy (SECM) feedback approach for measuring lateral proton diffusion in langmuir monolayers: theory and application Zhang, Jie; Unwin, Patrick R. Physical Chemistry Chemical Physics, Vol. 4, Issue 15 https://doi.org/10.1039/b111399b	journal	July 2002
Direct Imaging of Lattice Atoms and Topological Defects in Graphene Membranes Meyer, Jannik C.; Kisielowski, C.; Erni, R. Nano Letters, Vol. 8, Issue 11 https://doi.org/10.1021/nl801386m	journal	November 2008
Impermeable Atomic Membranes from Graphene Sheets Bunch, J. Scott; Verbridge, Scott S.; Alden, Jonathan S. Nano Letters, Vol. 8, Issue 8 https://doi.org/10.1021/nl801457b	journal	August 2008
Precise and Ultrafast Molecular Sieving Through Graphene Oxide Membranes Joshi, R. K.; Carbone, P.; Wang, F. C. Science, Vol. 343, Issue 6172 https://doi.org/10.1126/science.1245711	journal	February 2014
Properties of Hydrated Excess Protons near Phospholipid Bilayers Yamashita, Takefumi; Voth, Gregory A. The Journal of Physical Chemistry B, Vol. 114, Issue 1 https://doi.org/10.1021/jp908768c	journal	January 2010
Microinjection in combination with microfluorimetry to study proton diffusion along phospholipid membranes Antonenko, Yuri N.; Pohl, Peter European Biophysics Journal, Vol. 37, Issue 6 https://doi.org/10.1007/s00249-008-0295-y	journal	March 2008
Characterization of the Solvation and Transport of the Hydrated Proton in the Perfluorosulfonic Acid Membrane Nafion Petersen, Matt K.; Voth, Gregory A. The Journal of Physical Chemistry B, Vol. 110, Issue 37 https://doi.org/10.1021/jp062719k	journal	September 2006
Interaction of Magnesium Ions with Pristine Single-Layer and Defected Graphene/Water Interfaces Studied by Second Harmonic Generation Achtyl, Jennifer L.; Vlassiouk, Ivan V.; Surwade, Sumedh P. The Journal of Physical Chemistry B, Vol. 118, Issue 28 https://doi.org/10.1021/jp410298e	journal	February 2014
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set Kresse, G.; Furthmüller, J. Computational Materials Science, Vol. 6, Issue 1, p. 15-50 https://doi.org/10.1016/0927-0256(96)00008-0	journal	July 1996
Direct evidence for atomic defects in graphene layers Hashimoto, Ayako; Suenaga, Kazu; Gloter, Alexandre Nature, Vol. 430, Issue 7002 https://doi.org/10.1038/nature02817	journal	August 2004
Electrochemistry at the Edge of a Single Graphene Layer in a Nanopore Banerjee, Shouvik; Shim, Jiwook; Rivera, Jose ACS Nano, Vol. 7, Issue 1 https://doi.org/10.1021/nn305400n	journal	December 2012
Halide-Induced Cooperative Acid–Base Behavior at a Negatively Charged Interface Azam, Md. Shafiul; Weeraman, Champika N.; Gibbs-Davis, Julianne M. The Journal of Physical Chemistry C, Vol. 117, Issue 17 https://doi.org/10.1021/jp401164r	journal	April 2013
Polarization of water molecules at a charged interface: second harmonic studies of the silica/water interface Ong, Shaowei; Zhao, Xiaolin; Eisenthal, Kenneth B. Chemical Physics Letters, Vol. 191, Issue 3-4 https://doi.org/10.1016/0009-2614(92)85309-X	journal	April 1992
Localized proton microcircuits at the biological membrane-water interface Branden, M.; Sanden, T.; Brzezinski, P. Proceedings of the National Academy of Sciences, Vol. 103, Issue 52 https://doi.org/10.1073/pnas.0605909103	journal	December 2006
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set Kresse, G.; Furthmüller, J. Physical Review B, Vol. 54, Issue 16, p. 11169-11186 https://doi.org/10.1103/PhysRevB.54.11169	journal	October 1996
Lateral Proton Diffusion Rates along Stearic Acid Monolayers Slevin, Christopher J.; Unwin, Patrick R. Journal of the American Chemical Society, Vol. 122, Issue 11 https://doi.org/10.1021/ja993148v	journal	March 2000
Accurate Measurement of Electron Beam Induced Displacement Cross Sections for Single-Layer Graphene Meyer, Jannik C.; Eder, Franz; Kurasch, Simon Physical Review Letters, Vol. 108, Issue 19 https://doi.org/10.1103/PhysRevLett.108.196102	journal	May 2012
ReaxFF: A Reactive Force Field for Hydrocarbons van Duin, Adri C. T.; Dasgupta, Siddharth; Lorant, Francois The Journal of Physical Chemistry A, Vol. 105, Issue 41 https://doi.org/10.1021/jp004368u	journal	October 2001
Excited-State Proton Transfer and Proton Diffusion near Hydrophilic Surfaces Soroka, Hagit Peretz; Simkovitch, Ron; Kosloff, Alon The Journal of Physical Chemistry C, Vol. 117, Issue 48 https://doi.org/10.1021/jp4087514	journal	November 2013
Interfacial Acidities, Charge Densities, Potentials, and Energies of Carboxylic Acid-Functionalized Silica/Water Interfaces Determined by Second Harmonic Generation Konek, Christopher T.; Musorrafiti, Michael J.; Al-Abadleh, Hind A. Journal of the American Chemical Society, Vol. 126, Issue 38 https://doi.org/10.1021/ja0474300	journal	September 2004
Graphene Visualizes the First Water Adlayers on Mica at Ambient Conditions Xu, K.; Cao, P.; Heath, J. R. Science, Vol. 329, Issue 5996 https://doi.org/10.1126/science.1192907	journal	September 2010
Kinetic Studies of Chromium (VI) Binding to Carboxylic Acid- and Methyl Ester-Functionalized Silica/Water Interfaces Important in Geochemistry Al-Abadleh, Hind A.; Mifflin, Amanda L.; Musorrafiti, Michael J. The Journal of Physical Chemistry B, Vol. 109, Issue 35 https://doi.org/10.1021/jp053006p	journal	September 2005
Free Energy Relationships in the Electrical Double Layer over Single-Layer Graphene Achtyl, Jennifer L.; Vlassiouk, Ivan V.; Fulvio, Pasquale F. Journal of the American Chemical Society, Vol. 135, Issue 3 https://doi.org/10.1021/ja3120899	journal	January 2013
Selective Ionic Transport through Tunable Subnanometer Pores in Single-Layer Graphene Membranes O’Hern, Sean C.; Boutilier, Michael S. H.; Idrobo, Juan-Carlos Nano Letters, Vol. 14, Issue 3 https://doi.org/10.1021/nl404118f	journal	February 2014
Liquid flow along a solid surface reversibly alters interfacial chemistry Lis, D.; Backus, E. H. G.; Hunger, J. Science, Vol. 344, Issue 6188 https://doi.org/10.1126/science.1253793	journal	June 2014
An electron microscope for the aberration-corrected era Krivanek, O. L.; Corbin, G. J.; Dellby, N. Ultramicroscopy, Vol. 108, Issue 3 https://doi.org/10.1016/j.ultramic.2007.07.010	journal	February 2008
Improved tangent estimate in the nudged elastic band method for finding minimum energy paths and saddle points Henkelman, Graeme; Jónsson, Hannes The Journal of Chemical Physics, Vol. 113, Issue 22 https://doi.org/10.1063/1.1323224	journal	December 2000
Porous Graphene as the Ultimate Membrane for Gas Separation Jiang, De-en; Cooper, Valentino R.; Dai, Sheng Nano Letters, Vol. 9, Issue 12, p. 4019-4024 https://doi.org/10.1021/nl9021946	journal	December 2009
Structure and Dynamics of OH ^- (aq) Tuckerman, Mark E.; Chandra, Amalendu; Marx, Dominik Accounts of Chemical Research, Vol. 39, Issue 2 https://doi.org/10.1021/ar040207n	journal	February 2006
Interaction of Nitrate, Barium, Strontium and Cadmium Ions with Fused Quartz/Water Interfaces Studied by Second Harmonic Generation Hayes, Patrick L.; Malin, Jessica N.; Konek, Christopher T. The Journal of Physical Chemistry A, Vol. 112, Issue 4 https://doi.org/10.1021/jp076976g	journal	January 2008
Atomistic Origins of High Rate Capability and Capacity of N-Doped Graphene for Lithium Storage Wang, Xi; Weng, Qunhong; Liu, Xizheng Nano Letters, Vol. 14, Issue 3 https://doi.org/10.1021/nl4038592	journal	February 2014
High-resolution X-ray luminescence extension imaging Ou, Xiangyu; Qin, Xian; Huang, Bolong Nature, Vol. 590, Issue 7846 https://doi.org/10.1038/s41586-021-03251-6	journal	February 2021
Surface science Forbes, Richard Physics Bulletin, Vol. 24, Issue 11 https://doi.org/10.1088/0031-9112/24/11/045	journal	November 1973
Thermodynamics and Proton Transport in Nafion Choi, Pyoungho; Jalani, Nikhil H.; Datta, Ravindra Journal of The Electrochemical Society, Vol. 152, Issue 8 https://doi.org/10.1149/1.1945668	journal	January 2005
Graphene Nucleation Density on Copper: Fundamental Role of Background Pressure Vlassiouk, Ivan; Smirnov, Sergei; Regmi, Murari Carnegie Mellon University https://doi.org/10.1184/r1/6506876	text	January 2013
Thermodynamics and Proton Transport in Nafion Choi, Pyoungho; Jalani, Nikhil H.; Datta, Ravindra Journal of The Electrochemical Society, Vol. 152, Issue 3 https://doi.org/10.1149/1.1855872	journal	January 2005
Graphene Nucleation Density on Copper: Fundamental Role of Background Pressure Vlassiouk, Ivan; Smirnov, Sergei; Regmi, Murari Carnegie Mellon University https://doi.org/10.1184/r1/6506876.v1	text	January 2013
Impermeable Atomic Membranes from Graphene Sheets Bunch, J. Scott; Verbridge, Scott S.; Alden, Jonathan S. arXiv https://doi.org/10.48550/arxiv.0805.3309	text	January 2008
Unimpeded permeation of water through helium-leak-tight graphene-based membranes Nair, R. R.; Wu, H. A.; Jayaram, P. N. arXiv https://doi.org/10.48550/arxiv.1112.3488	text	January 2011
An accurate measurement of electron beam induced displacement cross sections for single-layer graphene Meyer, J. C.; Eder, F.; Kurasch, S. arXiv https://doi.org/10.48550/arxiv.1203.2372	text	January 2012
Precise and ultrafast molecular sieving through graphene oxide membranes Joshi, R. K.; Carbone, P.; Wang, F. C. arXiv https://doi.org/10.48550/arxiv.1401.3134	text	January 2014
Proton transport through one atom thick crystals Hu, S.; Lozada-Hidalgo, M.; Wang, F. C. arXiv https://doi.org/10.48550/arxiv.1410.8724	text	January 2014
Molecular Dynamics Simulation of Proton Transport Near the Surface of a Phospholipid Membrane Smondyrev, Alexander M.; Voth, Gregory A. Biophysical Journal, Vol. 82, Issue 3 https://doi.org/10.1016/s0006-3495(02)75500-8	journal	March 2002
Reverse occlusion leads to a precise restoration of orientation preference maps in visual cortex Kim, Dae-Shik; Bonhoeffer, Tobias Nature, Vol. 370, Issue 6488 https://doi.org/10.1038/370370a0	journal	August 1994

Cited By (38)

On the Origin of Ion Selectivity in Ultrathin Nanopores: Insights for Membrane-Scale Osmotic Energy Conversion Cao, Liuxuan; Wen, Qi; Feng, Yaping Advanced Functional Materials, Vol. 28, Issue 39 https://doi.org/10.1002/adfm.201804189	journal	August 2018
Modeling Diffusion in Functional Materials: From Density Functional Theory to Artificial Intelligence Elbaz, Yuval; Furman, David; Caspary Toroker, Maytal Advanced Functional Materials https://doi.org/10.1002/adfm.201900778	journal	July 2019
State-of-the-Art and Future Prospects for Atomically Thin Membranes from 2D Materials Prozorovska, Liudmyla; Kidambi, Piran R. Advanced Materials, Vol. 30, Issue 52 https://doi.org/10.1002/adma.201801179	journal	August 2018
Barrier Reduction of Lithium Ion Tunneling through Graphene with Hybrid Defects: First-Principles Calculations Xin, Yanbo; Huang, Anping; Hu, Qi Advanced Theory and Simulations, Vol. 1, Issue 2 https://doi.org/10.1002/adts.201700009	journal	January 2018
Modification of poly(vinylidene fluoride) membranes with aluminum oxide nanowires and graphene oxide nanosheets for oil-water separation Guo, Fanjin; Zhang, Chang; Wang, Qiaoying Journal of Applied Polymer Science https://doi.org/10.1002/app.47493	journal	January 2019
Fundamental transport mechanisms, fabrication and potential applications of nanoporous atomically thin membranes Wang, Luda; Boutilier, Michael S. H.; Kidambi, Piran R. Nature Nanotechnology, Vol. 12, Issue 6 https://doi.org/10.1038/nnano.2017.72	journal	June 2017
The ReaxFF reactive force-field: development, applications and future directions Senftle, Thomas P.; Hong, Sungwook; Islam, Md Mahbubul npj Computational Materials, Vol. 2, Issue 1 https://doi.org/10.1038/npjcompumats.2015.11	journal	March 2016
Polymerization driven monomer passage through monolayer chemical vapour deposition graphene Zhang, Tao; Liao, Zhongquan; Sandonas, Leonardo Medrano Nature Communications, Vol. 9, Issue 1 https://doi.org/10.1038/s41467-018-06599-y	journal	October 2018
Aqueous proton-selective conduction across two-dimensional graphyne Shi, Le; Xu, Ao; Pan, Ding Nature Communications, Vol. 10, Issue 1 https://doi.org/10.1038/s41467-019-09151-8	journal	March 2019
Transparent proton transport through a two-dimensional nanomesh material Xu, Jiyu; Jiang, Hongyu; Shen, Yutian Nature Communications, Vol. 10, Issue 1 https://doi.org/10.1038/s41467-019-11899-y	journal	September 2019
Perfect proton selectivity in ion transport through two-dimensional crystals Mogg, L.; Zhang, S.; Hao, G. -P. Nature Communications, Vol. 10, Issue 1 https://doi.org/10.1038/s41467-019-12314-2	journal	September 2019
Outlook for graphene-based desalination membranes Boretti, Albert; Al-Zubaidy, Sarim; Vaclavikova, Miroslava npj Clean Water, Vol. 1, Issue 1 https://doi.org/10.1038/s41545-018-0004-z	journal	May 2018
Giant photoeffect in proton transport through graphene membranes Lozada-Hidalgo, Marcelo; Zhang, Sheng; Hu, Sheng Nature Nanotechnology, Vol. 13, Issue 4 https://doi.org/10.1038/s41565-017-0051-5	journal	January 2018
Phase transitions of ordered ice in graphene nanocapillaries and carbon nanotubes Raju, Muralikrishna; van Duin, Adri; Ihme, Matthias Scientific Reports, Vol. 8, Issue 1 https://doi.org/10.1038/s41598-018-22201-3	journal	March 2018
A reduced graphene oxide nanofiltration membrane intercalated by well-dispersed carbon nanotubes for drinking water purification Chen, Xianfu; Qiu, Minghui; Ding, Hao Nanoscale, Vol. 8, Issue 10 https://doi.org/10.1039/c5nr08697c	journal	January 2016
Energetics and diffusion of liquid water and hydrated ions through nanopores in graphene: ab initio molecular dynamics simulation Guerrero-Avilés, Raúl; Orellana, Walter Physical Chemistry Chemical Physics, Vol. 19, Issue 31 https://doi.org/10.1039/c7cp03449k	journal	January 2017
Counting charges on membrane-bound peptides McGeachy, Alicia C.; Caudill, Emily R.; Liang, Dongyue Chemical Science, Vol. 9, Issue 18 https://doi.org/10.1039/c8sc00804c	journal	January 2018
Anomalous proton conduction behavior across a nanoporous two-dimensional conjugated aromatic polymer membrane Shi, Le; Ying, Zhixuan; Xu, Ao Physical Chemistry Chemical Physics, Vol. 22, Issue 5 https://doi.org/10.1039/c9cp06372b	journal	January 2020
Design of ultrathin hybrid membranes with improved retention efficiency of molecular dyes Liu, Peng; Milletto, Charles; Monti, Susanna RSC Advances, Vol. 9, Issue 49 https://doi.org/10.1039/c9ra04435c	journal	January 2019
Relative permittivity in the electrical double layer from nonlinear optics Boamah, Mavis D.; Ohno, Paul E.; Geiger, Franz M. The Journal of Chemical Physics, Vol. 148, Issue 22 https://doi.org/10.1063/1.5011977	journal	June 2018
2D nanoporous membrane for cation removal from water: Effects of ionic valence, membrane hydrophobicity, and pore size Köhler, Mateus Henrique; Bordin, José Rafael; Barbosa, Marcia C. The Journal of Chemical Physics, Vol. 148, Issue 22 https://doi.org/10.1063/1.5013926	journal	June 2018
Quantum tunneling of thermal protons through pristine graphene Poltavsky, Igor; Zheng, Limin; Mortazavi, Majid The Journal of Chemical Physics, Vol. 148, Issue 20 https://doi.org/10.1063/1.5024317	journal	May 2018
Theoretical description of quantum mechanical permeation of graphene membranes by charged hydrogen isotopes Mazzuca, James W.; Haut, Nathaniel K. The Journal of Chemical Physics, Vol. 148, Issue 22 https://doi.org/10.1063/1.5027821	journal	June 2018
Proton and hydrogen transport through two-dimensional monolayers Seel, Max; Pandey, Ravindra 2D Materials, Vol. 3, Issue 2 https://doi.org/10.1088/2053-1583/3/2/025004	journal	March 2016
A molecular dynamics based study to estimate the point defects formation energies in graphene containing STW defects Singla, Vibhor; Verma, Akarsh; Parashar, Avinash Materials Research Express, Vol. 6, Issue 1 https://doi.org/10.1088/2053-1591/aae637	journal	October 2018
Defect formation dynamics in dry and water submerged graphene nanosheets Sharma, Saurabh S.; Sharma, Bharat Bhushan; Parashar, Avinash Materials Research Express, Vol. 6, Issue 7 https://doi.org/10.1088/2053-1591/ab19fc	journal	April 2019
Sieving hydrogen isotopes through two-dimensional crystals Lozada-Hidalgo, M.; Hu, S.; Marshall, O. Science, Vol. 351, Issue 6268 https://doi.org/10.1126/science.aac9726	journal	December 2015
Prediction of perturbed proton transfer networks Reidelbach, Marco; Weber, Marcus; Imhof, Petra PLOS ONE, Vol. 13, Issue 12 https://doi.org/10.1371/journal.pone.0207718	journal	December 2018
Sieving hydrogen isotopes through two dimensional crystals Lozada-Hidalgo, M.; Hu, S.; Marshall, O. arXiv https://doi.org/10.48550/arxiv.1511.06693	text	January 2015
Relative Permittivity in the Electrical Double Layer from Nonlinear Optics Boamah, Mavis D.; Ohno, Paul E.; Geiger, Franz M. arXiv https://doi.org/10.48550/arxiv.1702.02496	text	January 2017
Density Functional Based Simulations of Proton Permeation of Graphene and Hexagonal Boron Nitride Kroes, J. M. H.; Fasolino, A.; Katsnelson, M. I. arXiv https://doi.org/10.48550/arxiv.1702.03813	text	January 2017
Perfect proton selectivity in ion transport through two-dimensional crystals Mogg, L.; Zhang, S.; Hao, G. -P. arXiv https://doi.org/10.48550/arxiv.1908.07852	text	January 2019
Proton Acceptor near the Active Site Lowers Dramatically the O–O Bond Formation Energy Barrier in Photocatalytic Water Splitting Shao, Yang; de Groot, Huub J. M.; Buda, Francesco The Journal of Physical Chemistry Letters, Vol. 10, Issue 24 https://doi.org/10.1021/acs.jpclett.9b02914	journal	November 2019
Kinetic Ionic Permeation and Interfacial Doping of Supported Graphene Jia, Xiaoyu; Hu, Min; Soundarapandian, Karuppasamy Nano Letters, Vol. 19, Issue 12 https://doi.org/10.1021/acs.nanolett.9b04053	journal	November 2019
Specifics About Specific Ion Adsorption from Heterodyne-Detected Second Harmonic Generation Boamah, Mavis D.; Ohno, Paul; Lozier, Emilie Physical Chemistry https://doi.org/10.26434/chemrxiv.8108819.v1	journal	May 2019
Polymerization driven monomer passage through monolayer chemical vapour deposition graphene Zhang, Tao; Liao, Zhongquan; Sandonas, Leonardo Medrano [London] : Nature Publishing Group UK https://doi.org/10.34657/9858	text	January 2018
Phase-referenced Nonlinear Spectroscopy of the alpha-Quartz/Water Interface Ohno, Paul E.; Saslow, Sarah A.; Wang, Hong-fei arXiv https://doi.org/10.48550/arxiv.1606.09310	text	January 2016
Scalable and efficient separation of hydrogen isotopes using graphene-based electrochemical pumping Lozada-Hidalgo, M.; Zhang, S.; Hu, S. arXiv https://doi.org/10.48550/arxiv.1702.07562	text	January 2017

Similar Records

A charge-transfer resistance model and Arrhenius activation analysis for hydrogen ion transmission across single-layer graphene

Journal Article · Sat Nov 03 00:00:00 EDT 2018 · Electrochimica Acta · OSTI ID:1210480

Bukola, Saheed; Creager, Stephen E.

Selective Nanoscale Mass Transport across Atomically Thin Single Crystalline Graphene Membranes

Journal Article · Fri Mar 17 00:00:00 EDT 2017 · Advanced Materials · OSTI ID:1210480

Kidambi, Piran R.; Boutilier, Michael S. H.; Wang, Luda; +3 more

Energetics of a Li Atom adsorbed on B/N doped graphene with monovacancy

Journal Article · Mon Aug 15 00:00:00 EDT 2016 · Journal of Solid State Chemistry · OSTI ID:1210480

Rani, Babita; Jindal, V. K.; Dharamvir, Keya

Related Subjects

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY
36 MATERIALS SCIENCE
catalysis (heterogeneous)
solar (fuels)
energy storage (including batteries and capacitors)
hydrogen and fuel cells
electrodes - solar
mechanical behavior
charge transport
materials and chemistry by design
synthesis (novel materials)
72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS

Title: Aqueous proton transfer across single-layer graphene

Citation Formats

References (73)

Cited By (38)

Similar Records

Related Subjects