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1 n which the unpaired electron is extensively delocalized.
2 -GlcNAc levels are increased and OGT and OGA delocalized.
3 Au, bonding of the latter two being broadly delocalized.
4 O analysis shows that the aromatic system is delocalized.
5 e only monomeric radical which remains fully delocalized.
6 riplet state is again found to be completely delocalized.
7 r being highly molecular and the latter more delocalized.
8 excited states of these nanorings are highly delocalized.
9 ontrast, nucleosomes in MIC are dramatically delocalized.
11 es are MoModeltadelta* for both I and II but delocalized (3)MLCT for I(') and localized (3)MLCT for I
12 ne axes, while their LUMOs remain relatively delocalized across the molecule, except in cruciforms su
14 ed spin having distinct P-like character and delocalized among the icosahedral Au(13) core of the par
15 yeast lacking Nup132 (Sc/HuNUP133), Ulp1 is delocalized and can no longer antagonize sumoylation of
17 electrostatic interactions with the DNA are delocalized and followed by aquation to form the monoaqu
18 ined states to band-like charge transport in delocalized and hybridized states of strongly coupled QD
19 elding pattern implies the existence of both delocalized and localized currents that have a dominant
20 he self-assembly of diamondoids, form highly delocalized and symmetric electron-deficient structures.
22 kinase previously found to be overexpressed, delocalized, and constitutively active in CLL cells.
24 gy transfer mechanism leads to excitation of delocalized, anticorrelated vibrational wavepackets on t
28 e for collective behavior of macroscopically delocalized atomic states, a crucial element for new pro
29 s (COEs), molecules that are defined by a pi-delocalized backbone and terminal ionic pendant groups,
30 the IR photons promote bound charge pairs to delocalized band states, similar to those formed just af
33 in seedlings exposed to stress, but becomes delocalized before being degraded following removal of s
35 ed as either localized on one sulfur atom or delocalized between two indistinguishable sulfur atoms.
37 in an effective Hamiltonian that couples the delocalized Bogoliubov modes of the two mechanical oscil
38 chemical bond is generally given in terms of delocalized bonding orbitals, or, alternatively, in term
40 Bonding and charge density analyses indicate delocalized bonding within the gold host and the (Au,T)3
41 s observed experimentally arises mostly from delocalized bound-state excitations of the electron rath
42 g 7 times faster for quinones attached via a delocalized bridge as compared to a saturated alkane cha
46 a polarization of the pi electrons along the delocalized C2-C1-O system in the key cyclopropyl-carben
47 and 3(2H)-thiophenone (3H-S) by a series of delocalized carbanions and by CN(-), and the identity pr
51 in the droplets) yielding anions with highly delocalized charge [quantified by the weighted average p
52 nd physical or chemical properties of excess delocalized charge carriers in semiconductor nanocrystal
53 Photoexcitation leads to the formation of a delocalized charge resonance state (S1) that relaxes qui
55 ominated by molecular (Frenkel) exictons and delocalized charges are promptly produced (t < 100 fs).
57 nction as molecular wires with transport via delocalized charges, rather than the hopping mechanism t
58 omatic and antiaromatic molecules-which have delocalized circuits of [4n + 2] or [4n] electrons, resp
59 esults in electron localized Class II-III or delocalized Class III structures that display distinct N
60 y narrow asymmetric bands, characteristic of delocalized class-III bis(diarylamino) species, to narro
61 re discussed within the framework of a fully delocalized cluster exhibiting strong double and direct
62 ong contributions to the binding energy from delocalized, collective charge fluctuations-in contrast
64 -type) colloidal ZnO nanocrystals possessing delocalized conduction-band (CB) electrons can be formed
65 nanocrystals (NCs) involves recombination of delocalized conduction-band electrons with copper-locali
68 f the two boron pz-type orbitals, with small delocalized contributions of the 9-borafluorenyl pi syst
69 model, on the superconducting side, one has delocalized Cooper pairs but localized vortices; while o
70 this system into a superconducting fluid of delocalized Cooper pairs in momentum space (k-space).
73 und that CT at the interface first populates delocalized CT excitons with a coherent size of 4 nm.
75 lts support a model of charge separation via delocalized CT states independent of excess heterojuncti
76 formulation of the CuA center as an electron-delocalized Cu(1.5)-Cu(1.5) system implicates both Cu(II
78 nitial bright singlet state (species I) to a delocalized dark state (species II), driven by interacti
79 ws that all of the above compounds are fully delocalized despite differences among the sites of lithi
80 nding and antibonding linear combinations of delocalized dioxolene (SQ/Cat) valence frontier molecula
82 aggressive and inflammatory in nature, with delocalized E-cadherin and elevated expression of Il23a,
83 I) borates, a Pu 6p orbital is observed with delocalized electron density on basal oxygen atoms contr
87 mplexes lead to highly coherent domains with delocalized electronic states displaying metallic behavi
88 s owe their optoelectronic properties to the delocalized electronic structure along their conjugated
89 zations reveal that the metal centers have a delocalized electronic structure, and that their true ge
93 pitaxial connections will lead to completely delocalized electrons and may enable the observation of
94 understand the exchange interaction between delocalized electrons and pinned magnetic impurities in
95 as YbAl3, interactions between localized and delocalized electrons can lead to fluctuations between t
96 highly stabilizing feature of molecules with delocalized electrons in closed circuits, is generally r
97 ysics supports this view, demonstrating that delocalized electrons make a static macroscopic polariza
98 ized status (e.g., polyaromatics), with more delocalized electrons obtained for enhanced Maxwell-Wagn
101 ination of differently planarized and charge-delocalized enolate tautomers by anion-pi interactions.
103 find that on a 50 fs time scale an initially delocalized excess electron localizes on a single [Tf2N(
104 its complete dichroism can be attributed to delocalized excitations along ...I3-...I3-... chains.
105 al pigments combine to form this manifold of delocalized excited states that effectively harvests lig
107 circular dichroism, superradiance, and fast delocalized exciton transfer, consistent with our quantu
109 ectly inform on the relationship between the delocalized excitons and the individual chlorophylls thr
110 cylinders' soft mesoscopic structure, robust delocalized excitons are retained: Internal order and st
111 r between clusters of a few pigments sharing delocalized excitons has been challenged by ultrafast op
113 ersion of a synthetic complex with a valence-delocalized [Fe(3.5)(micro-O)(2)Fe(3.5)](3+) diamond cor
114 he double exchange parameter, B, for valence-delocalized [Fe2S2](+) centers and demonstrate that vari
115 ) provide the only known examples of valence-delocalized [Fe2S2](+) clusters, which constitute a fund
116 rve as a sensitive probe for correlations in delocalized fermionic quantum states and for quantum met
117 tions imply that itinerant ferromagnetism of delocalized fermions is possible without lattice and ban
119 uasi-two-dimensional layers characterized by delocalized free-particle-like states in the vicinity of
123 ional results indicate a unique role for the delocalized frontier molecular orbitals of the Fe(NO)2 u
124 d to increase electron affinity and maintain delocalized frontier orbitals while significantly decrea
126 re carried out to determine how localized or delocalized holes on a polymer chain are and to compare
128 otogeneration occurs predominately via these delocalized hot exciton states in competition with relax
129 arge generation across large polymer phases, delocalized hot excitons may also account for the crucia
131 vent-exposed hydrophobic cluster and another delocalized hydrophobic core in the folding kinetics, ar
132 , and those whose O-H stretch vibrations are delocalized, i.e., shared between multiple O-H bonds.
136 phy suggests that the unpaired electrons are delocalized in each case across two inner 4,4'-bipyridin
138 ules showed that their pi electrons remained delocalized in individual benzenoid-type rings rather th
139 localized in real space (r-space) and those delocalized in momentum-space (k-space) generates exotic
140 a Ni(III) complex with one unpaired electron delocalized in the ligands surrounding the metal center.
141 culations show that the unpaired electron is delocalized in the low pH form and reveal that its four-
143 that a significant fraction of the charge is delocalized in the tert-butyl group of the radical catio
144 oring HRAS, NRAS or KRAS mutations, SCH66336 delocalized, inhibited signaling and preferentially inhi
145 r interaction with Ag (or Cu) as involving a delocalized interaction with contributions from the carb
146 molecular nature of the exciton and the more delocalized intermolecular nature of electrons and holes
147 base pair, we also observe the emergence of delocalized, interstrand CT excitations, whose excitatio
152 the ground state of the drug shows a highly delocalized lone pair on the amine nitrogen of the melph
153 oxygen-induced trap level, 0.34 eV below the delocalized lowest unoccupied molecular orbital of P(NDI
158 and the atoms contributing to the absorbing delocalized mode in the crystal structure were deduced u
160 ipolar and quadrupolar electric and magnetic delocalized modes, only dipolar electric and quadrupolar
161 e rationalized by considering a qualitative, delocalized molecular orbital description, which provide
162 mpounds correlated well with the energy of a delocalized molecular orbital first appearing on an arom
166 functional theory calculations highlight the delocalized nature of the low energy singlet excited sta
167 studies have been complicated by the highly delocalized nature of the porphyrin, and calculations re
168 these functionally important regions form a delocalized network of residues that are dynamically cou
170 xygen lone pair on flat sites, whereas it is delocalized on both C and O atoms on concave sites, incr
171 e cyclohexene-bridged Z-derivatives are spin-delocalized on the EPR time scale but charge-localized o
172 he magnetic interaction between the electron delocalized on the fullerene cage and the guest H2 has b
174 r C-S bond cleavage, and the charge and spin delocalized on their structures, were also useful to end
175 uggest unpaired electron density is strongly delocalized onto the non-innocent [N(3)] ligand, with a
177 ulations demonstrate that the electron spins delocalized onto the thiophene unit lead to the accelera
179 ws that the photogenerated plasmon is highly delocalized onto TiO2, and thus, it is shared by the ele
180 on the possible role of charge transfer and delocalized or excitonic states in the photophysics of t
181 es this coupling indicates that high-spin pi-delocalized organic molecules could find applications as
183 and IR spectra indicates that the polaron is delocalized over 2-3 porphyrin units in the linear oligo
185 sfer includes the fact that the excitons are delocalized over a few neighboring sites, but the role o
186 ons, it is proposed that the MLCT states are delocalized over both benzoate Cr(CO)(3) groups, as supp
187 unsym/sym-[1(CO)](+), the unpaired spin was delocalized over both iron centers, as indicated by the
192 ls with lowest unoccupied molecular orbitals delocalized over the 1,4-di(pyridin-4-yl)buta-1,3-diyne
193 concentric pi-systems, with two pi-electrons delocalized over the central pentagonal B unit and anoth
194 The unpaired electron in this molecule is delocalized over the entire helical core composed of six
196 ex suggests the formation of a radical anion delocalized over the neighboring PDI units, and this res
197 produced by charge separation are frequently delocalized over the pi systems of the final oxidized do
198 a localized HOMO topology while the LUMO is delocalized over the polymer backbone, so that the lowes
199 One of these VTs has the charge and spin delocalized over the porphyrin and the styrylruthenium m
201 but for P-TMI the NTOs have electron density delocalized over the two units as a result of extensive
202 LUMO level of Mo(tfd)(3) is calculated to be delocalized over the whole molecule, which is expected t
203 iron in the case of the S = 1/2 compound, or delocalized over the {Fe(NO)} unit in the S = 0 complex.
204 e of a carbon nanotube because electrons are delocalized over thousands of atomic sites, and rapidly
206 les of sigma-bonds made of a single electron delocalized over two neighboring atoms were until recent
207 dulated internal structure and is coherently delocalized over two unit cells of the LiF crystal (appr
209 at the edge of transformed patches including delocalized p120-catenin and E-cadherin as well as invas
210 s is especially so in systems of interacting delocalized particles, for which a direct experimental m
214 theoretical model that explores how coherent delocalized phonon-like modes in DNA provide single-stra
215 results support the conclusion that coherent delocalized phonon-like modes play an important role in
216 by invoking exciton self-trapping, in which delocalized photogenerated holes contract in response to
217 re doubly aromatic, each with six completely delocalized pi and sigma electrons, which describe the b
218 e highly stable and doubly aromatic with six delocalized pi and six delocalized sigma electrons and s
219 und to exhibit triple pi aromaticity with 11 delocalized pi bonds, analogous to benzo(g,h,i)perylene
220 ation indicated the feasibility of combining delocalized pi electrons and spin-polarized d electrons
222 arge-transfer (CT) excited state between the delocalized pi electrons of the carbon linker and the Si
224 icenter ptC strip stems from both the highly delocalized pi orbital of ZGNRs and nearly perfect match
225 closed-shell B(22)(2-) species reveal seven delocalized pi orbitals, which are similar to those in a
226 gether, the spectroscopic results revealed a delocalized pi radical on the enamine-thiazolium interme
229 ent with charge separation through access to delocalized pi-electron states in ordered regions of the
230 posite design by the incorporation of both a delocalized pi-electrons system in a closely bound accep
231 carbon basal plane, conferred upon it by the delocalized pi-electrons, (i) causes a downshift of e(g)
232 BODIPY core is feasible, a hemicyanine-like delocalized pi-system gives rise to novel blue and effic
237 ton-localization microscopy reveals that the delocalized plasmons are capable of focusing multiple na
241 nodal excitations from gapped (localized) to delocalized quasiparticles characterized by a longer lif
242 lic hydroxyl to give a quinone methide and a delocalized radical in the heptadienone chain that under
243 upon deprotonation is largest when a highly delocalized radical is combined with an initially less s
245 ed, such that the hydrophobic electronically delocalized region positions within the inner membrane w
249 CD saturation magnetization data for valence-delocalized S = 9/2 [Fe2S2](+) centers facilitated deter
250 and investigating the properties of valence-delocalized S = 9/2 [Fe2S2](+) fragments in higher nucle
251 imilar valence-localized S = 1/2 and valence-delocalized S = 9/2 forms as a function of pH, with pKa
252 s in partial or full conversion from valence-delocalized S = 9/2 to valence-localized S = 1/2 [Fe2S2]
253 e observation that mixed-valence para-Fe2 is delocalized shows that electron localization in meta-Fe2
254 he all-boron fullerene, bonded uniformly via delocalized sigma and pi bonds, is not perfectly smooth
255 hey satisfy the 4n+2 rule of aromaticity for delocalized sigma electrons and fulfill other requiremen
256 bly aromatic with six delocalized pi and six delocalized sigma electrons and should exist for a serie
259 ddition reaction of a thermally generated pi-delocalized singlet vinylcarbene, the intramolecular var
260 ry photoexcitations in conjugated dimers are delocalized singlets that enable fast and efficient iSF.
261 pairing result from in-phase overlap of the delocalized SOMOs on neighboring molecules-that is the i
262 re therefore converted into relatively inert delocalized species A(*) and/or B(*) that inhibit the ch
263 te complex 1 generates a 37-electron valence-delocalized species with no gross structural reorganizat
266 ronic structure with an unexpected partially delocalized spin, as evidenced by electron paramagnetic
273 onally to localized surface states or to the delocalized states of the QD core, (ii) energy or electr
274 fur ions on the surfaces of the QDs (and not delocalized states within the QDs) are the electron dono
278 lecular systems containing an electronically delocalized structure are the basis of emerging optoelec
279 rporation of targeting moieties into the non-delocalized structure of pentamethine and heptamethine i
280 uity that 1,2-dihydro-1,2-azaborines possess delocalized structures consistent with aromaticity.
281 ity of electronic structure in this strongly delocalized superchromophore and reflect the complicatio
282 esonances transitions to that from spatially delocalized surface plasmon excitations, exhibiting mult
283 the addition and removal of electrons from a delocalized system should lead to considerable increases
285 boron atoms in the dihydrides are bonded by delocalized three-, four-, or five-center sigma and pi b
286 en-shell molecules, in which spin density is delocalized through a helical conjugated backbone, hold
287 ybrid theory, the parent radicals of AOs are delocalized through allylic rearrangement, and as a cons
288 isotopic labeling shows that the radical is delocalized throughout the adenine ring of A2503, althou
291 ocenyl cations, the transition from a charge delocalized to a localized state is addressed by resonan
292 h transiently expressed SEC6A1A variants are delocalized to the Golgi, a finding confirmed in a renal
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