Small molecule crystals with 1D water wires modulate electronic properties of surface water networks
Abstract
This work evaluates the effect of water vapor pressure on the surface conductivity of a hydrated small molecule crystal under dry and wet conditions. The crystal contains a discrete metal complex with waters of hydration in structural positions and in 1D water wires. Under dry conditions, the surface of the hydrated crystal behaves as a near ideal capacitor. Under wet conditions, the waters of hydration serve as a template to assemble surface water networks by organization of water from the environment. The surface water provides pathways for charge transfer attributed to proton mobility that increases conductivity by > 3 orders in magnitude. Modulation between wet and dry conditions tunes the conductivity of the crystal surface via a two-step process, which has been evaluated kinetically as a function of the water vapor pressure.
- Authors:
-
- Univ. of Louisville, KY (United States). Dept. of Chemistry
- Univ. of Louisville, KY (United States). Dept. of Chemical Engineering
- Univ. of Louisville, KY (United States). Dept. of Chemistry; Middle Tennessee State Univ., Murfreesboro, TN (United States). Dept. of Chemistry
- Univ. of Louisville, KY (United States). Dept. of Physics and Astronomy
- Publication Date:
- Research Org.:
- Univ. of Louisville, KY (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC)
- OSTI Identifier:
- 1849835
- Alternate Identifier(s):
- OSTI ID: 1781185
- Grant/Contract Number:
- FG02-08CH11538; CHE-1665136; CHE1800245
- Resource Type:
- Accepted Manuscript
- Journal Name:
- Applied Materials Today
- Additional Journal Information:
- Journal Volume: 22; Journal Issue: C; Journal ID: ISSN 2352-9407
- Publisher:
- Elsevier
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 36 MATERIALS SCIENCE; Materials Science; Surface conductivity; Electronic properties; Proton mobility; Water wires; Humidity sensor
Citation Formats
Saraei, Nina, Gupta, Alexander J., Hietsoi, Oleksandr, Frye, Brian C., Hofsommer, Dillon T., Sumanasekera, Gamini, Gupta, Gautam, Mashuta, Mark S., Buchanan, Robert M., and Grapperhaus, Craig A. Small molecule crystals with 1D water wires modulate electronic properties of surface water networks. United States: N. p., 2020.
Web. doi:10.1016/j.apmt.2020.100895.
Saraei, Nina, Gupta, Alexander J., Hietsoi, Oleksandr, Frye, Brian C., Hofsommer, Dillon T., Sumanasekera, Gamini, Gupta, Gautam, Mashuta, Mark S., Buchanan, Robert M., & Grapperhaus, Craig A. Small molecule crystals with 1D water wires modulate electronic properties of surface water networks. United States. https://doi.org/10.1016/j.apmt.2020.100895
Saraei, Nina, Gupta, Alexander J., Hietsoi, Oleksandr, Frye, Brian C., Hofsommer, Dillon T., Sumanasekera, Gamini, Gupta, Gautam, Mashuta, Mark S., Buchanan, Robert M., and Grapperhaus, Craig A. Sun .
"Small molecule crystals with 1D water wires modulate electronic properties of surface water networks". United States. https://doi.org/10.1016/j.apmt.2020.100895. https://www.osti.gov/servlets/purl/1849835.
@article{osti_1849835,
title = {Small molecule crystals with 1D water wires modulate electronic properties of surface water networks},
author = {Saraei, Nina and Gupta, Alexander J. and Hietsoi, Oleksandr and Frye, Brian C. and Hofsommer, Dillon T. and Sumanasekera, Gamini and Gupta, Gautam and Mashuta, Mark S. and Buchanan, Robert M. and Grapperhaus, Craig A.},
abstractNote = {This work evaluates the effect of water vapor pressure on the surface conductivity of a hydrated small molecule crystal under dry and wet conditions. The crystal contains a discrete metal complex with waters of hydration in structural positions and in 1D water wires. Under dry conditions, the surface of the hydrated crystal behaves as a near ideal capacitor. Under wet conditions, the waters of hydration serve as a template to assemble surface water networks by organization of water from the environment. The surface water provides pathways for charge transfer attributed to proton mobility that increases conductivity by > 3 orders in magnitude. Modulation between wet and dry conditions tunes the conductivity of the crystal surface via a two-step process, which has been evaluated kinetically as a function of the water vapor pressure.},
doi = {10.1016/j.apmt.2020.100895},
journal = {Applied Materials Today},
number = C,
volume = 22,
place = {United States},
year = {Sun Dec 06 00:00:00 EST 2020},
month = {Sun Dec 06 00:00:00 EST 2020}
}
Works referenced in this record:
Co–Ca Phosphonate Showing Humidity-Sensitive Single Crystal to Single Crystal Structural Transformation and Tunable Proton Conduction Properties
journal, November 2015
- Bao, Song-Song; Li, Nan-Zhu; Taylor, Jared M.
- Chemistry of Materials, Vol. 27, Issue 23
Proton Conduction in a Single Crystal of a Phosphonato‐Sulfonate‐Based Coordination Polymer: Mechanistic Insight
journal, February 2020
- Javed, Ali; Wagner, Thorsten; Wöhlbrandt, Stephan
- ChemPhysChem, Vol. 21, Issue 7
Proton Transfer, Acid-Base Catalysis, and Enzymatic Hydrolysis. Part I: ELEMENTARY PROCESSES
journal, January 1964
- Eigen, M.
- Angewandte Chemie International Edition in English, Vol. 3, Issue 1
Unusual dynamics of hydration water around motor proteins with long-ranged hydrodynamic fluctuations
journal, November 2019
- Sharma, Shivangi; Biswas, Parbati
- Physica A: Statistical Mechanics and its Applications, Vol. 534
High and Highly Anisotropic Proton Conductivity in Organic Molecular Porous Materials
journal, June 2011
- Yoon, Minyoung; Suh, Kyungwon; Kim, Hyunuk
- Angewandte Chemie International Edition, Vol. 50, Issue 34
Single-crystal X-ray diffraction studies on structural transformations of porous coordination polymers
journal, January 2014
- Zhang, Jie-Peng; Liao, Pei-Qin; Zhou, Hao-Long
- Chem. Soc. Rev., Vol. 43, Issue 16
A “Molecular Water Pipe”: A Giant Tubular Cluster {Dy 72 } Exhibits Fast Proton Transport and Slow Magnetic Relaxation
journal, November 2016
- Qin, Lei; Yu, You-Zhu; Liao, Pei-Qin
- Advanced Materials, Vol. 28, Issue 48
Open-Framework Chalcogenide Showing Both Intrinsic Anhydrous and Water-Assisted High Proton Conductivity
journal, January 2018
- Luo, Hong-Bin; Wang, Mei; Zhang, Jin
- ACS Applied Materials & Interfaces, Vol. 10, Issue 3
Analyzing protein topology based on Laguerre tessellation of a pore-traversing water network
journal, September 2018
- Esque, Jérémy; Sansom, Mark S. P.; Baaden, Marc
- Scientific Reports, Vol. 8, Issue 1
Homomeric and heteromeric self-assembly of hybrid ureido–imidazole compounds
journal, January 2008
- Legrand, Yves-Marie; Michau, Mathieu; van der Lee, Arie
- CrystEngComm, Vol. 10, Issue 5
Inherent Proton Conduction in a 2D Coordination Framework
journal, July 2012
- Umeyama, Daiki; Horike, Satoshi; Inukai, Munehiro
- Journal of the American Chemical Society, Vol. 134, Issue 30
Water Structure and Properties at Hydrophilic and Hydrophobic Surfaces
journal, June 2020
- Monroe, Jacob; Barry, Mikayla; DeStefano, Audra
- Annual Review of Chemical and Biomolecular Engineering, Vol. 11, Issue 1
Water Permeation Across Biological Membranes: Mechanism and Dynamics of Aquaporin-1 and GlpF
journal, December 2001
- de Groot, B. L.
- Science, Vol. 294, Issue 5550
Insulator-to-Proton-Conductor Transition in a Dense Metal–Organic Framework
journal, May 2015
- Tominaka, Satoshi; Coudert, François-Xavier; Dao, Thang D.
- Journal of the American Chemical Society, Vol. 137, Issue 20
“Sticky”-Ends-Guided Creation of Functional Hollow Nanopores for Guest Encapsulation and Water Transport
journal, April 2016
- Huo, Yanping; Zeng, Huaqiang
- Accounts of Chemical Research, Vol. 49, Issue 5
Eigen and Zundel Forms of Small Protonated Water Clusters: Structures and Infrared Spectra
journal, October 2007
- Park, Mina; Shin, Ilgyou; Singh, N. Jiten
- The Journal of Physical Chemistry A, Vol. 111, Issue 42
Proton transfer through hydrogen bonds in two-dimensional water layers: A theoretical study based on ab initio and quantum-classical simulations
journal, January 2015
- Bankura, Arindam; Chandra, Amalendu
- The Journal of Chemical Physics, Vol. 142, Issue 4
Positively charged residues at the channel mouth boost single-file water flow
journal, January 2018
- Horner, Andreas; Siligan, Christine; Cornean, Alex
- Faraday Discussions, Vol. 209
Single Crystal to Single Crystal Structural Transformations in Molecular Framework Materials
journal, January 2006
- Halder, Gregory J.; Kepert, Cameron J.
- Australian Journal of Chemistry, Vol. 59, Issue 9
Synthesis, structural characterisation and proton conduction of two new hydrated phases of barium ferrite BaFeO 2.5−x (OH) 2x
journal, January 2016
- Knöchel, Patrick L.; Keenan, Philip J.; Loho, Christoph
- Journal of Materials Chemistry A, Vol. 4, Issue 9
The Grotthuss mechanism
journal, October 1995
- Agmon, Noam
- Chemical Physics Letters, Vol. 244, Issue 5-6
Water wire clusters in isostructural Cu(II) and Ni(II) complexes: Synthesis, characterization, and thermal analyses
journal, June 2019
- Saraei, Nina; Hietsoi, Oleksandr; Frye, Brian C.
- Inorganica Chimica Acta, Vol. 492
How Water’s Properties Are Encoded in Its Molecular Structure and Energies
journal, September 2017
- Brini, Emiliano; Fennell, Christopher J.; Fernandez-Serra, Marivi
- Chemical Reviews, Vol. 117, Issue 19
A Simple Strategy for Crystal Engineering Water Clusters
journal, December 2007
- Sansam, Benedict C. R.; Anderson, Kirsty M.; Steed, Jonathan W.
- Crystal Growth & Design, Vol. 7, Issue 12
Anisotropic Water-Mediated Proton Conductivity in Large Iron(II) Metal–Organic Framework Single Crystals for Proton-Exchange Membrane Fuel Cells
journal, December 2018
- Bunzen, Hana; Javed, Ali; Klawinski, Danielle
- ACS Applied Nano Materials, Vol. 2, Issue 1
Robust Multifunctional Yttrium-Based Metal–Organic Frameworks with Breathing Effect
journal, January 2017
- Firmino, Ana D. G.; Mendes, Ricardo F.; Antunes, Margarida M.
- Inorganic Chemistry, Vol. 56, Issue 3
Highly Anisotropic and Water Molecule-Dependent Proton Conductivity in a 2D Homochiral Copper(II) Metal–Organic Framework
journal, February 2017
- Li, Rong; Wang, Shuai-Hua; Chen, Xu-Xing
- Chemistry of Materials, Vol. 29, Issue 5
Proton Transport through Water-Filled Carbon Nanotubes
journal, March 2003
- Dellago, Christoph; Naor, Mor M.; Hummer, Gerhard
- Physical Review Letters, Vol. 90, Issue 10
Proton Conductivity: Materials and Applications
journal, January 1996
- Kreuer, Klaus-Dieter
- Chemistry of Materials, Vol. 8, Issue 3
Polarized Water Wires under Confinement in Chiral Channels
journal, July 2015
- Barboiu, Mihail; Cazade, Pierre-André; Le Duc, Yann
- The Journal of Physical Chemistry B, Vol. 119, Issue 28
Small Water Clusters in Crystalline Hydrates
journal, September 2003
- Supriya, Sabbani; Das, Samar K.
- Journal of Cluster Science, Vol. 14, Issue 3
Structures and Solid-State Dynamics of One-Dimensional Water Chains Stabilized by Imidazole Channels
journal, November 2003
- Cheruzel, Lionel E.; Pometun, Maxim S.; Cecil, Matthew R.
- Angewandte Chemie International Edition, Vol. 42, Issue 44
Energiebänder der tunnelnden Überschuß-Protonen in flüssigen Säuren. Eine IR-spektroskopische Untersuchung der Natur der Gruppierungen H 5 O 2 +
journal, April 1968
- Zundel, G.; Metzger, H.
- Zeitschrift für Physikalische Chemie, Vol. 58, Issue 5_6
From Natural to Bioassisted and Biomimetic Artificial Water Channel Systems
journal, January 2013
- Barboiu, Mihail; Gilles, Arnaud
- Accounts of Chemical Research, Vol. 46, Issue 12
Diffusion of Water in a Nonporous Hydrophobic Crystal
journal, June 2005
- Thallapally, Praveen K.; Lloyd, Gareth O.; Atwood, Jerry L.
- Angewandte Chemie International Edition, Vol. 44, Issue 25
Water Determines the Structure and Dynamics of Proteins
journal, April 2016
- Bellissent-Funel, Marie-Claire; Hassanali, Ali; Havenith, Martina
- Chemical Reviews, Vol. 116, Issue 13
Ultrafast Graphene Oxide Humidity Sensors
journal, November 2013
- Borini, Stefano; White, Richard; Wei, Di
- ACS Nano, Vol. 7, Issue 12
Graph-set analysis of hydrogen-bond patterns in organic crystals
journal, April 1990
- Etter, M. C.; MacDonald, J. C.; Bernstein, J.
- Acta Crystallographica Section B Structural Science, Vol. 46, Issue 2