A first-principles study on the effect of phosphorus-doped palladium catalyst for formic acid dissociation

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Vol 387 ◽  
pp. 221-227 ◽  
Author(s):  
Feng He ◽  
Kai Li ◽  
Cong Yin ◽  
Ying Wang ◽  
Menggai Jiao ◽  
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First Principles ◽  
Palladium Catalyst ◽  
Acid Dissociation ◽  
First Principles Study ◽  
Phosphorus Doped

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Hongwei Gong ◽  
Tong Zhang ◽  
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First Principles ◽  
Single Atom ◽  
Hydrogenation Of Co2 ◽  
First Principles Study

The mechanisms of oxygen reduction reaction on phosphorus doped graphene: A first-principles study

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Author(s):  
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Zhansheng Lu ◽  
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Keyword(s):  
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Oxygen Reduction ◽  
First Principles ◽  
Reduction Reaction ◽  
First Principles Study ◽  
Doped Graphene ◽  
Phosphorus Doped

A first principles study of the binding of formic acid in catalase complementing high resolution X-ray structures

2006 ◽  
Vol 323 (1) ◽  
pp. 129-137 ◽  
Author(s):  
Carme Rovira ◽  
Mercedes Alfonso-Prieto ◽  
Xevi Biarnés ◽  
Xavi Carpena ◽  
Ignacio Fita ◽  
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Keyword(s):  
High Resolution ◽  
Formic Acid ◽  
First Principles ◽  
X Ray ◽  
First Principles Study

A first-principles study of formic acid adsorption on CaO(001)

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Keyword(s):  
Formic Acid ◽  
First Principles ◽  
First Principles Study
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