In pursuit of negative Fukui functions: examples where the highest occupied molecular orbital fails to dominate the chemical reactivity.
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A reference-free stockholder partitioning method based on the force on electrons.A Novel Schiff Base of 3-acetyl-4-hydroxy-6-methyl-(2H)pyran-2-one and 2,2'-(ethylenedioxy)diethylamine as Potential Corrosion Inhibitor for Mild Steel in Acidic Medium.How predictive could alchemical derivatives be?In pursuit of negative Fukui functions: molecules with very small band gaps.Structural effects in octahedral carbonyl complexes: an atoms-in-molecules studyWhy is the dual descriptor a more accurate local reactivity descriptor than Fukui functions?
P2860
In pursuit of negative Fukui functions: examples where the highest occupied molecular orbital fails to dominate the chemical reactivity.
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2012 nî lūn-bûn
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In pursuit of negative Fukui f ...... inate the chemical reactivity.
@en
In pursuit of negative Fukui f ...... inate the chemical reactivity.
@nl
type
label
In pursuit of negative Fukui f ...... inate the chemical reactivity.
@en
In pursuit of negative Fukui f ...... inate the chemical reactivity.
@nl
prefLabel
In pursuit of negative Fukui f ...... inate the chemical reactivity.
@en
In pursuit of negative Fukui f ...... inate the chemical reactivity.
@nl
P2093
P2860
P1476
In pursuit of negative Fukui f ...... inate the chemical reactivity.
@en
P2093
Carlos Cárdenas
Eleonora Echegaray
Farnaz Heidar Zadeh
James S M Anderson
Nataly Rabi
Paul W Ayers
Sandra Rabi
Sungmin Lee
P2860
P2888
P304
P356
10.1007/S00894-012-1637-3
P577
2012-10-23T00:00:00Z
P5875
P6179
1025368713