Suggested Topics within your search.
Suggested Topics within your search.
теорiя функцiонала густини
DFT
4
density functional theory
3
Raman spectroscopy
2
раманiвська спектроскопiя
2
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1
F¨orster mechanism
1
GeTiO3 compound
1
Mulliken charge distribution
1
RDG diagram
1
RDG дiаграма
1
Structural materials
1
amyl acetate
1
approximation
1
bending
1
carbon-based hybrid nanostructure
1
compression
1
dye molecule
1
elastic properties
1
electron localization function
1
electronic structure
1
ethanol
1
first-principle calculations
1
graphene
1
heptane
1
hydrogen bonding
1
intermolecular interactions
1
localized orbital locator
1
magnetic materials
1
magnetic moment
1
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