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High-performance computing may improve combustion efficiency
August 30, 2005
Rising oil prices have revved momentum to develop more efficient combustion systems. But instrumental to this goal is a need to achieve greater understanding of the complex chemical reactions involved in combustion processes. In one of the largest simulations ever brought to bear on this problem, researchers at Pacific Northwest National Laboratory performed quantum chemical calculations to accurately predict the heat of formation of octane, a key component of gasoline.
The calculation-performed using 1,400 parallel processors-took only 23 hours to complete and achieved a sustained effi ciency of 75 percent, compared to the 5 to 10 percent effi ciency of most codes. For comparison, the best one-processor desktop computer would have required a three and a half years and 2.5 terabytes of memory to run the calculation.
These pioneering calculations also helped identify the level of theory needed for subsequent efforts to reliably predict the heat of formation of larger alkanes in diesel fuel, for which there is very little experimental data, and the heat of formation of key reactive intermediates, such as alkyl and alkoxy radicals, for which there is no experimental data.
DOE/Pacific Northwest National Laboratory
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Related Combustion Current Events and Combustion News Articles Combustion Current Events and Combustion News RSS Oak Ridge supercomputer is the world's fastest for science A Cray XT high-performance computing system at the Department of Energy's (DOE) Oak Ridge National Laboratory is the world's fastest supercomputer for science.
Hydrogen tank lighter than battery Dutch-sponsored researcher Robin Gremaud has shown that an alloy of the metals magnesium, titanium and nickel is excellent at absorbing hydrogen.
The groundbreaking science behind what aims to be the fastest vehicle of all time The world record bid again teams Andy, the current record holder and first man to drive a supersonic vehicle on land with Head of the Design Team and former world record holder Richard Noble.
When it comes to forest soil, wildfires pack 1-2 punch For decades, scientists and resource managers have known that wildfires affect forest soils, evidenced, in part, by the erosion that often occurs after a fire kills vegetation and disrupts soil structure.
Emissions rising faster this decade than last The latest figures on the global carbon budget to be released in Washington and Paris today indicate a four-fold increase in growth rate of human-generated carbon dioxide emissions since 2000.
Simple device which uses electrical field could boost gas efficiency With the high cost of gasoline and diesel fuel impacting costs for automobiles, trucks, buses and the overall economy, a Temple University physics professor has developed a simple device which could dramatically improve fuel efficiency as much as 20 percent.
Growth in the global carbon budget Today the new Global Carbon Budget was launched simultaneously by Global Carbon Project co-chair Michael Raupach in France at the Paris Observatory, and in the USA at Capitol Hill, Washington by GCP Executive Director Pep Canadell.
'Chemical Equator' discovery will aid pollution mapping Scientists at the University of York have discovered a 'Chemical Equator' that divides the polluted air of the Northern Hemisphere from the largely uncontaminated atmosphere of the Southern Hemisphere.
Iowa State engineer works to clean and improve engine performance The five engines in Song-Charng Kong's Iowa State University laboratory have come a long way since Karl Benz patented a two-stroke internal combustion engine in 1879.
Engineers develop a laser solution to power plants slowed by slagging Quietly, and with little of the fanfare accompanying the relentless surge in gasoline costs, the price of coal has doubled in less than a year. More Combustion Current Events and Combustion News Articles
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