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Accounting for the thermo-stability of PdHx (x = 1-3) by density functional theory

Article ID Journal Published Year Pages File Type
10154648 International Journal of Hydrogen Energy 2018 10 Pages PDF
Keywords
PdHxFormation enthalpyThermodynamic stabilitydynamic stabilityCluster expansion methodDensity functional theory
Related Topics
Physical Sciences and Engineering Chemistry Electrochemistry
Preview
Accounting for the thermo-stability of PdHx (x = 1-3) by density functional theory
Authors
Debing Long, Mingkai Li, Dongxue Meng, Yunbin He, Im Taek Yoon, Rajeev Ahuja, Wei Luo,
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Journal
International Journal of Hydrogen Energy
Journal: International Journal of Hydrogen Energy
Related Categories
PdHx
Formation enthalpy
Thermodynamic stability
dynamic stability
Cluster expansion method
Density functional theory
Analytical Chemistry
Chemistry (General)
Electrochemistry
Inorganic Chemistry
Organic Chemistry
Physical and Theoretical Chemistry
Spectroscopy
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