Forum for Science, Industry and Business

Sponsored by:     3M 
Search our Site:

 

ORNL researchers discover new state of water molecule

25.04.2016

Neutron scattering and computational modeling have revealed unique and unexpected behavior of water molecules under extreme confinement that is unmatched by any known gas, liquid or solid states.

In a paper published in Physical Review Letters, researchers at the Department of Energy's Oak Ridge National Laboratory describe a new tunneling state of water molecules confined in hexagonal ultra-small channels - 5 angstrom across - of the mineral beryl. An angstrom is 1/10-billionth of a meter, and individual atoms are typically about 1 angstrom in diameter.


ORNL researchers discovered that water in beryl displays some unique and unexpected characteristics.

Photo by Jeff Scovil

The discovery, made possible with experiments at ORNL's Spallation Neutron Source and the Rutherford Appleton Laboratory in the United Kingdom, demonstrates features of water under ultra confinement in rocks, soil and cell walls, which scientists predict will be of interest across many disciplines.

"At low temperatures, this tunneling water exhibits quantum motion through the separating potential walls, which is forbidden in the classical world," said lead author Alexander Kolesnikov of ORNL's Chemical and Engineering Materials Division. "This means that the oxygen and hydrogen atoms of the water molecule are 'delocalized' and therefore simultaneously present in all six symmetrically equivalent positions in the channel at the same time. It's one of those phenomena that only occur in quantum mechanics and has no parallel in our everyday experience."

The existence of the tunneling state of water shown in ORNL's study should help scientists better describe the thermodynamic properties and behavior of water in highly confined environments such as water diffusion and transport in the channels of cell membranes, in carbon nanotubes and along grain boundaries and at mineral interfaces in a host of geological environments.

ORNL co-author Lawrence Anovitz noted that the discovery is apt to spark discussions among materials, biological, geological and computational scientists as they attempt to explain the mechanism behind this phenomenon and understand how it applies to their materials.

"This discovery represents a new fundamental understanding of the behavior of water and the way water utilizes energy," Anovitz said. "It's also interesting to think that those water molecules in your aquamarine or emerald ring - blue and green varieties of beryl - are undergoing the same quantum tunneling we've seen in our experiments."

While previous studies have observed tunneling of atomic hydrogen in other systems, the ORNL discovery that water exhibits such tunneling behavior is unprecedented. The neutron scattering and computational chemistry experiments showed that, in the tunneling state, the water molecules are delocalized around a ring so the water molecule assumes an unusual double top-like shape.

"The average kinetic energy of the water protons directly obtained from the neutron experiment is a measure of their motion at almost absolute zero temperature and is about 30 percent less than it is in bulk liquid or solid water," Kolesnikov said. "This is in complete disagreement with accepted models based on the energies of its vibrational modes."

First principle simulations made by Narayani Choudhury of Lake Washington Institute of Technology and University of Washington-Bothell showed that the tunneling behavior is coupled to the vibrational dynamics of the beryl structure.

Co-authors of the paper, titled "Quantum Tunneling of Water in Beryl: a New State of the Water Molecule," were Timothy Prisk, Eugene Mamontov, Andrey Podlesnyak, George Ehlers and David Wesolowski of ORNL, George Reiter of the University of Houston and Andrew Seel of Rutherford Appleton Laboratory. Funding for this research was provided by DOE's Office of Basic Energy Sciences. The SNS is a DOE Office of Science User Facility. The paper is available at http://journals.aps.org/prl/abstract/10.1103/PhysRevLett.116.167802

UT-Battelle manages ORNL for the DOE's Office of Science. The Office of Science is the single largest supporter of basic research in the physical sciences in the United States, and is working to address some of the most pressing challenges of our time. For more information, please visit http://science.energy.gov/.

###

Image: https://www.ornl.gov/sites/default/files/news/images/berylCoverImage_horz.jpg

Cutline: ORNL researchers discovered that water in beryl displays some unique and unexpected characteristics. (Photo by Jeff Scovil)

NOTE TO EDITORS: You may read other press releases from Oak Ridge National Laboratory or learn more about the lab at http://www.ornl.gov/news. Additional information about ORNL is available at the sites below:

Twitter - http://twitter.com/ornl

RSS Feeds - http://www.ornl.gov/ornlhome/rss_feeds.shtml

Flickr - http://www.flickr.com/photos/oakridgelab

YouTube - http://www.youtube.com/user/OakRidgeNationalLab

LinkedIn - http://www.linkedin.com/companies/oak-ridge-national-laboratory

Facebook - http://www.facebook.com/Oak.Ridge.National.Laboratory

Media Contact

Ron Walli
wallira@ornl.gov
865-576-0226

 @ORNL

http://www.ornl.gov 

Ron Walli | EurekAlert!

More articles from Life Sciences:

nachricht How brains surrender to sleep
23.06.2017 | IMP - Forschungsinstitut für Molekulare Pathologie GmbH

nachricht A new technique isolates neuronal activity during memory consolidation
22.06.2017 | Spanish National Research Council (CSIC)

All articles from Life Sciences >>>

The most recent press releases about innovation >>>

Die letzten 5 Focus-News des innovations-reports im Überblick:

Im Focus: Can we see monkeys from space? Emerging technologies to map biodiversity

An international team of scientists has proposed a new multi-disciplinary approach in which an array of new technologies will allow us to map biodiversity and the risks that wildlife is facing at the scale of whole landscapes. The findings are published in Nature Ecology and Evolution. This international research is led by the Kunming Institute of Zoology from China, University of East Anglia, University of Leicester and the Leibniz Institute for Zoo and Wildlife Research.

Using a combination of satellite and ground data, the team proposes that it is now possible to map biodiversity with an accuracy that has not been previously...

Im Focus: Climate satellite: Tracking methane with robust laser technology

Heatwaves in the Arctic, longer periods of vegetation in Europe, severe floods in West Africa – starting in 2021, scientists want to explore the emissions of the greenhouse gas methane with the German-French satellite MERLIN. This is made possible by a new robust laser system of the Fraunhofer Institute for Laser Technology ILT in Aachen, which achieves unprecedented measurement accuracy.

Methane is primarily the result of the decomposition of organic matter. The gas has a 25 times greater warming potential than carbon dioxide, but is not as...

Im Focus: How protons move through a fuel cell

Hydrogen is regarded as the energy source of the future: It is produced with solar power and can be used to generate heat and electricity in fuel cells. Empa researchers have now succeeded in decoding the movement of hydrogen ions in crystals – a key step towards more efficient energy conversion in the hydrogen industry of tomorrow.

As charge carriers, electrons and ions play the leading role in electrochemical energy storage devices and converters such as batteries and fuel cells. Proton...

Im Focus: A unique data centre for cosmological simulations

Scientists from the Excellence Cluster Universe at the Ludwig-Maximilians-Universität Munich have establised "Cosmowebportal", a unique data centre for cosmological simulations located at the Leibniz Supercomputing Centre (LRZ) of the Bavarian Academy of Sciences. The complete results of a series of large hydrodynamical cosmological simulations are available, with data volumes typically exceeding several hundred terabytes. Scientists worldwide can interactively explore these complex simulations via a web interface and directly access the results.

With current telescopes, scientists can observe our Universe’s galaxies and galaxy clusters and their distribution along an invisible cosmic web. From the...

Im Focus: Scientists develop molecular thermometer for contactless measurement using infrared light

Temperature measurements possible even on the smallest scale / Molecular ruby for use in material sciences, biology, and medicine

Chemists at Johannes Gutenberg University Mainz (JGU) in cooperation with researchers of the German Federal Institute for Materials Research and Testing (BAM)...

All Focus news of the innovation-report >>>

Anzeige

Anzeige

Event News

Plants are networkers

19.06.2017 | Event News

Digital Survival Training for Executives

13.06.2017 | Event News

Global Learning Council Summit 2017

13.06.2017 | Event News

 
Latest News

Quantum thermometer or optical refrigerator?

23.06.2017 | Physics and Astronomy

A 100-year-old physics problem has been solved at EPFL

23.06.2017 | Physics and Astronomy

Equipping form with function

23.06.2017 | Information Technology

VideoLinks
B2B-VideoLinks
More VideoLinks >>>