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Decarboxylation of furfural on Pd(111): Ab initio molecular dynamics simulations
Decarboxylation of furfural on Pd(111): Ab initio molecular dynamics simulations
2013
Wenhua Xue
Hongli Dang
Darwin Shields
Yingdi Liu
Friederike C. Jentoft
Daniel E. Resasco
Sanwu Wang
Keywords:
Ab initio
Photochemistry
Chemistry
Decarboxylation
Molecular dynamics
Furfural
Computational chemistry
ab initio molecular dynamics
Correction
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