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Toh, P.-L
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Toh, P.-L
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Density functional theory investigations on the geometric and electronic structures of 4-Azidomethyl-6-Isopropyl-2H-Chromen-2-One
by
Ang, L.S
,
Guojian C.
,
Meepripruk, M.
,
Mohamed-Ibrahim, M.I
,
Muhammad Y.
,
Sulaiman, S.
,
Toh
,
P
.-
L
Published 2015
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Related Subjects
Atoms
B3LYP density functional
Carbon
Density functional theory
Electronic properties
Electronic structure
Experimental values
First-principle density-functional theories
Geometrical property
Geometry
Geometry optimization
Local energy minima
Mulliken atomic charges
Optimized geometries
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