Navigation Links
Water acts as catalyst in explosives
Date:3/20/2009

LIVERMORE, Calif. - The most abundant material on Earth exhibits some unusual chemical properties when placed under extreme conditions.

Lawrence Livermore National Laboratory scientists have shown that water, in hot dense environments, plays an unexpected role in catalyzing complex explosive reactions. A catalyst is a compound that speeds chemical reactions without being consumed. Platinum and enzymes are common catalysts. But water rarely, if ever, acts as a catalyst under ordinary conditions.

Detonations of high explosives made up of oxygen and hydrogen produce water at thousands of degrees Kelvin and up to 100,000 atmospheres of pressure, similar to conditions in the interiors of giant planets.

While the properties of pure water at high pressures and temperatures have been studied for years, this extreme water in a reactive environment has never been studied. Until now.

Using first-principle atomistic simulations of the detonation of the high explosive PETN (pentaerythritol tetranitrate), the team discovered that in water, when one hydrogen atom serves as a reducer and the hydroxide (OH) serves as an oxidizer, the atoms act as a dynamic team that transports oxygen between reaction centers.

"This was news to us," said lead researcher Christine Wu. "This suggests that water also may catalyze reactions in other explosives and in planetary interiors."

This finding is contrary to the current view that water is simply a stable detonation product.

"Under extreme conditions, water is chemically peculiar because of its frequent dissociations," Wu said. "As you compress it to the conditions you'd find in the interior of a planet, the hydrogen of a water molecule starts to move around very fast."

In the molecular dynamic simulations using the Lab's BlueGene L supercomputer, Wu and colleagues Larry Fried, Lin Yang, Nir Goldman and Sorin Bastea found that the hydrogen (H) and hydroxide (OH) atoms in water transport oxygen from nitrogen storage to carbon fuel under PETN detonation conditions (temperatures between 3,000 Kelvin and 4,200 Kelvin). Under both temperature conditions, this "extreme water" served both as an end product and as a key chemical catalyst.

For a molecular high explosive that is made up of carbon, nitrogen, oxygen and hydrogen, such as PETN, the three major gaseous products are water, carbon dioxide and molecular nitrogen.

But to date, the chemical processes leading to these stable compounds are not well understood.

The team found that nitrogen loses its oxygen mostly to hydrogen, not to carbon, even after the concentration of water reaches equilibrium. They also found that carbon atoms capture oxygen mostly from hydroxide, rather than directly from nitrogen monoxide (NO) or nitrogen dioxide (NO_). Meanwhile water disassociated and recombines with hydrogen and hydroxide frequently.

"The water that comes out is part of the energy release mechanism," Wu said. "This catalytic mechanism is completely different from previously proposed decomposition mechanisms for PETN or similar explosives, in which water is just an end product. This new discovery could have implications for scientists studying the interiors of Uranus and Neptune where water is in an extreme form."


'/>"/>

Contact: Anne Stark
stark8@llnl.gov
925-422-9799
DOE/Lawrence Livermore National Laboratory
Source:Eurekalert

Related biology news :

1. Research to secure a safe water supply
2. Dancing adatoms help chemists understand how water molecules split
3. Getting into hot water
4. EPA to study Puerto Rico waters and marine habitat
5. An underwater drugstore?
6. Forget the freezer: Research suggests novel way to control water behavior
7. Little Salt Spring underwater archeological site in Florida receives new funding
8. Nutrient pollution chokes marine and freshwater ecosystems
9. Capillary mats labor-saving, economical alternative to hand watering
10. Marine scientists to assess environment before offshore drilling begins in US arctic waters
11. Case Western Reserve researchers looking at light-induced toxins in air and water
Post Your Comments:
*Name:
*Comment:
*Email:
(Date:5/9/2016)... 2016 Elevay is currently known ... freedom for high net worth professionals seeking travel for ... connected world, there is still no substitute for a ... sealing your deal with a firm handshake. This is ... advantage of citizenship via investment programs like those offered ...
(Date:4/26/2016)... -- Research and Markets has announced the ...  report to their offering.  , ,     (Logo: ... forecast the global multimodal biometrics market to grow ... 2016-2020.  Multimodal biometrics is being implemented ... healthcare, BFSI, transportation, automotive, and government for controlling ...
(Date:4/13/2016)... , April 13, 2016  IMPOWER physicians supporting ... are setting a new clinical standard in telehealth thanks ... By leveraging the higi platform, IMPOWER patients can routinely ... pulse and body mass index, and, when they opt ... and convenient visit to a local retail location at ...
Breaking Biology News(10 mins):
(Date:6/23/2016)... June 23, 2016   Boston Biomedical , ... compounds designed to target cancer stemness pathways, announced ... granted Orphan Drug Designation from the U.S. Food ... gastric cancer, including gastroesophageal junction (GEJ) cancer. Napabucasin ... to inhibit cancer stemness pathways by targeting STAT3, ...
(Date:6/23/2016)... , ... June 23, 2016 , ... ... YM (Yeast and Mold) microbial test has received AOAC Research Institute approval 061601. ... microbial tests introduced last year,” stated Bob Salter, Vice President of Regulatory and ...
(Date:6/23/2016)... ... 2016 , ... Supplyframe, the Industry Network for electronics hardware ... . Located in Pasadena, Calif., the Design Lab’s mission is to bring together ... built and brought to market. , The Design Lab is Supplyframe’s physical representation ...
(Date:6/23/2016)...  Blueprint Bio, a company dedicated to identifying, protecting ... has closed its Series A funding round, according to ... "We have received a commitment from Forentis Fund that ... meet our current goals," stated Matthew Nunez . ... complete validation on the current projects in our pipeline, ...
Breaking Biology Technology: