Suggested Topics within your search.
Suggested Topics within your search.
density functional theory
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3
теорiя функцiонала густини
3
graphene
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теория функционала плотности
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теорія функціоналу густини
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CO2
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DFT
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F¨orster mechanism
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Ge atoms on surface
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GeTiO3 compound
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Hubbard U method
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Si (001) face
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Structural materials
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adsorption
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bending
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carbon-based hybrid nanostructure
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carbonic oxide
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catalytic activity
1
charge density
1
cluster approximation
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compression
1
conformers
1
dye molecule
1
elastic properties
1
electronic properties
1
electronic structure
1
first-principle calculations
1
gas sensors
1
glaciation
1
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