ライフサイエンスコーパス: ground state

1 between the product isomer and the original ground state.

2 buted much less to the overall ferromagnetic ground state.

3 equencies may enter their mechanical quantum ground state.

4 the electronically excited state back to the ground state.

5 opulation of virtual photons in the system's ground state.

6 omb iridates prevent access to a spin-liquid ground state.

7 d excitation between orbital branches of the ground state.

8 een cytostatic and polyphenols occurs in the ground state.

9 (NaK) molecules in the singlet rovibrational ground state.

10 diradical character that exists in a triplet ground state.

11 amics of the relaxation of the system to its ground state.

12 rently multiconfigurational character of the ground state.

13 from self-limiting growth to defects in the ground state.

14 omic potential and establishes an epigenetic ground state.

15 ring of charge into a quasi-2D charge stripe ground state.

16 an end-on superoxide complex with an S = 1/2 ground state.

17 f 1-O indicates an intermediate-spin (S = 1) ground state.

18 the chromophore 4-hydroxybenzyl group in the ground state.

19 ies of steps that return the receptor to its ground state.

20 the restoration of the visual pigment to its ground state.

21 ant of J = +2.69(5) cm(-1), to give an S = 1 ground state.

22 ely different from that of the original Mott ground state.

23 s, we uncover the ordering in the underdoped ground state.

24 is different from the AFM state near the FM ground state.

25 e symmetrical configuration displayed by the ground state.

26 V, is more consistent with a Mott insulating ground state.

27 tic, ground state to a splayed ferromagnetic ground state.

28 es derived from the instantaneous electronic ground state.

29 on to many important NP-hard problems as its ground state.

30 predicted to form the molecular J eff = 3/2 ground state.

31 strong enough to restore the symmetry of the ground state.

32 superfluidity and possible pair density wave ground state.

33 of size and proximity effects on correlated ground states.

34 m in 5d oxides can lead to exotic electronic ground states.

35 e clue about the possibility of other nearby ground states.

36 ic-field control of three different magnetic ground states.

37 rge transfer (CT) effect and Mott insulating ground states.

38 U(4) phases and new properties for potential ground states.

39 n is almost fully transferred between atomic ground states.

40 ucts PhBNN and PhBCO have triplet electronic ground states.

41 diradicals, one of which possesses a triplet ground state (2J/kB = 234 +/- 36 K) and robust stability

42 etween the first excited state (4)T1 and the ground state (6)A1 (normally >17,000 cm(-1)) while the l

43 optical gain threshold due to suppression of ground-state absorption by pre-existing carriers.

44 tunneling distance occurs through an unusual ground state active site arrangement or by thermally sam

45 nd 3 exhibits an excimer, and the associated ground-state aggregation is responsible for fluorescence

46 organic glass has a spin-frustrated doublet ground state and a thermally accessible quartet state.

47 ound exhibits a spin transition between a LS ground state and an ordered HS-LS phase with symmetry br

48 perovskite oxides have an antiferromagnetic ground state and around room temperatures, are paramagne

49 bility of a low lying alternative electronic ground state and by perturbation of the electrostatic po

50 ion of spin-allowed emission directly to the ground state and could be exploited as an increased driv

51 se the excited states in the vicinity of the ground state and demonstrate some advantage over traditi

52 e demonstrate is capable of both finding the ground state and describing the unitary time evolution o

53 mixture does not have a strong effect on the ground state and does not generate a hybrid orbital.

54 We present the ground state and energetically low structures of BenH2n

55 branches between internal conversion to the ground state and formation of a long-lived base-off spec

56 The spin ground state and ligand rearrangement are discussed with

57 ctive metal substitution can also switch the ground state and modify metal-metal and antibonding inte

58 t the ferromagnetic order is the most stable ground state and the magnetic moment will collapse at ab

59 al way to initialize spin systems into their ground state and therefore have applications in magnetic

60 the chromophore spans the two domains in the ground state and translocates fully into the NTD upon il

61 ic triradical trianions with spin-frustrated ground states and accessible 1D pores offers routes to n

62 lides open the door to new types of magnetic ground states and excitations, inconceivable a decade ag

63 vity and the dynamic interconversion between ground states and high-energy states can constitute the

64 ium and oxenium ions can have triplet pi,pi* ground states and provides a simple recipe for making io

65 , it follows that the structures of both the ground states and transition states on the binding react

66 tion-free Hamiltonians with exactly solvable ground states and uncover a remarkable quantum phase tra

67 ated quantum magnets not only provide exotic ground states and unusual magnetic structures, but also

68 s to provide an overview of the breakdown of ground-state and transition state effects in enzyme cata

69 mixing of low-lying excited states with the ground state, and covalency in the Bk(IV)-O bonds that d

70 g between the charge transfer states and the ground state, and lower activation energy for charge gen

71 mplexities, we prove that fcc lithium is the ground state, and we synthesize it by decompression.

72 is the availability of large numbers of cold ground state antihydrogen atoms.

73 n+1]/[4n+1] triplet biradical species in the ground state are obtained that display global aromaticit

74 d states.Materials with a Kitaev spin liquid ground state are sought after as models of quantum phase

75 ggest that at low temperatures holes in deep ground states are localized on N atoms axially bonded to

76 uperexchange that stabilizes a ferromagnetic ground state as observed around 2 K.

77 is molecular species has the same electronic ground state as the {IrO6}(8-) fragment, and thus emerge

78 es a zwitterionic resonance structure in the ground state, as evidenced by X-ray crystallography and

79 he major conformation of the peptides in the ground state, as suggested by (1)H NMR and computational

80 l initial state with ion motion close to the ground state, as well as a tuning of couplings between i

81 n only occur by a tunneling process from the ground state at cryogenic conditions.

82 greater than 1, resulting in a ferromagnetic ground state at filling factor nu = 2.

83 oxide (DBTO), have been suggested to release ground state atomic oxygen [O((3)P)] upon irradiation, a

84 nitially formed in the gas-phase reaction of ground-state atomic silicon (Si) with silane (SiH4 ) und

85 esolve the vibrational fine structure of the ground state band.

86 The ground-state bands yield electron affinities and vibrati

87 used to treat HIV infections reveal that the ground state binding is weaker and the activation enthal

88 ay is not thermodynamically favorable on the ground state but becomes more favorable, corresponding t

89 ays a subtle role in creating the electronic ground state but drives the magnetic order and emergence

90 The para radical has doublet ground state, but a band for a quartet state is missing

91 We show how ClpC is repressed in its ground state by determining ClpC cryo-EM structures with

92 Whereas the electronic ground-state calculations indicate a PP multiple bond ch

93 These ground states can be reversibly interchanged at RT by th

94 me via the bimolecular gas-phase reaction of ground-state carbon atoms with 1,3,5-cycloheptatriene (C

95 ssible via direct coupling with conventional ground-state catalysts.

96 subtracting a proportion of the confounding 'ground state'; changed states are objectively identified

97 Electronic coupling and ground-state charge transfer at the C60 /ZnO hybrid inte

98 ct, H12SubPc-TCBD-aniline showed significant ground-state charge transfer interactions between the H1

99 CS forms a ground-state complex by quenching the intrinsic fluoresc

100 mpeting states, and the theoretical magnetic ground state configuration, which is in agreement with n

101 geometrical frustration and manipulation of ground state configurations.

102 Cluster ground-state configurations have been predicted using pr

103 Moreover, the ground state conformation has been identified and it is

104 ic and amplitude information regarding their ground-state conformational fluctuations has remained el

105 The direct observation of multiple ground state conformations for peptides of this family,

106 sional representation of the SLO active site ground state contains a reactive (a) conformer with hydr

107 a given interacting model in terms of their ground-state correlations.

108 An understanding of this zygotic chromatin 'ground state' could potentially provide insights into re

109 transfer from the excited Coumarin 2 to the ground-state Coumarin 343 in the core, with the efficien

110 simplest metallic element, has a complicated ground-state crystal structure.

111 including the routine collection of multiple ground-state crystals.

112 nar gold(I) complexes are found to sensitize ground-state Cu(I)-Au(I) covalent bonds and near-unity p

113 bulky CF3 and iPr groups, constraints in the ground state decreased the expected DeltaG()rot values r

114 athways: the kinetic stability of a pMHCII's ground state defines its propensity for intrinsic peptid

115 nitrenium and oxenium ions can have triplet ground states depending upon the attachment position on

116 ng structured illumination microscopy (SIM), ground-state depletion (GSD), and total internal reflect

117 d sections from canine heart, we revealed by ground-state depletion and confocal microscopies that mo

118 lculations, which surprisingly revealed that ground state destabilization and transition state stabil

119 d EcAP monoesterases, including evidence for ground-state destabilization and functional active-site

120 cule with mu above 5 D, whereas in 2b and 2d ground state dipole moment is significantly reduced.

121 elds is potentially complicated by the large ground state dipole moment of the nitrile, which may irr

122 l rotor network due to the degeneracy of the ground-state dipole rotational energy barrier of the sys

123 We find the ground-state dissociation activation energy to be 4.74 e

124 nd dbtpy ligands, assume a high-spin quintet ground state due to substituent-induced intramolecular s

125 n undertaken and revealed the formation of a ground state electron donor-acceptor complex (EDA) betwe

126 ts are consistent with a mechanism involving ground-state electron donation or withdrawal to/from the

127 amics of the QD but also, in some cases, its ground state electronic structure.

128 The ground-state electronic order in doped manganites is fre

129 We discuss self-consistently obtained ground-state electronic properties of monolayers of grap

130 its high-quality photonic properties with a ground-state electronic spin, which can be read out opti

131 We introduce an energy functional for ground-state electronic structure calculations.

132 be cooled arbitrarily close to the motional ground state, enabling the exploration of quantum physic

133 cit construction of Ising Hamiltonians whose ground states encode the solution of SCP instances.

134 han one hundred Pauli terms, determining the ground-state energy for molecules of increasing size, up

135 pin splitting of conduction band edges makes ground state excitons radiatively inactive (dark) due to

136 spectral gap, which have a classical product ground state for all system sizes smaller than a particu

137 tz radicals and confirm S = 3 and S = 4 spin ground states for 1 and 2, respectively.

138 returns the reduced catalyst to the Cr(III) ground state, forming superoxide.

139 ferromagnetic Heisenberg exchange drives the ground state from ferro to zigzag order via a three-dime

140 Ground-state gold cluster cores were held together by th

141 It is an open question how these ground states governed by local rules are affected by di

142 icates that the substrate is deformed in the ground state (GS) of the reaction and partially resemble

143 teristic EPR spectrum consistent with a d(1) ground state, has the capacity for two-electron reductio

144 Whereas their featureless ground states have precluded their straightforward exper

145 idal-II <c + a>, which are distinct from the ground state hexagonal close packed alpha phase of Zr.

146 o the appearance of complex multi-Q magnetic ground states, hosting unusual states such as chiral den

147 ation problems typically involve finding the ground state (i.e. the minimum energy configuration) of

148 nsition from the charge-transfer (CT) to the ground state, i.e., CR, but at the same time are not imp

149 5 as well as the Schiff base nitrogen in the ground state in comparison to light-induced, cryotrapped

150 on in air by stabilizing the ferric thiolate ground state in contrast to its synthetic analogs.

151 These results demonstrate that the ground state in CuFe2Ge2 can be easily manipulated by ex

152 calculations that suggest a triplet ((3)A2) ground state in D3 symmetry involving two degenerate Sc-

153 the realization of the molecular J eff = 3/2 ground state in GaTa4Se8.The strong interaction between

154 Release from this ground state in minimal conditions offers a system for d

155 le, stabilizing a con-rotating ferrotoroidal ground state in Tb and Ho examples and extend the possib

156 nt phenomena, such as the emergence of polar ground states in some ferroic materials.

157 trum indicating that the anion has a singlet ground state, in contrast to previously reported calcula

158 ions, among which 17 have noncentrosymmetric ground states including two potential multiferroics.

159 magnet beta-Li2IrO3 from its incommensurate ground state into a quantum correlated paramagnet.

160 ctive state back to their biologically inert ground state is an integral part of GPCR signaling.

161 When the 3-substituent is a sigma-donor, the ground state is destabilized, and the reactivity is enha

162 The actual ground state is face-centered cubic (fcc).

163 the energy of a many-electron system in its ground state is fully defined by its electron density di

164 how that the previously accepted martensitic ground state is metastable.

165 ty measurements show that a low-spin S = 1/2 ground state is populated at 0-150 K, while both low-spi

166 s of muon-spin rotation, indicating that the ground state is reached via a freezing out of slow dynam

167 ne is an overall doublet whose return to the ground state is spin-allowed.

168 he photocatalyst in both the excited and the ground states is necessary to obtain a photocontrolled s

169 Their disparate ground states largely depend on transition metal d-elect

170 ability to serve as useful samplers from the ground-state manifolds of combinatorial optimization pro

171 strate that (i) quantum annealers sample the ground-state manifolds of spin glasses very differently

172 i) the experimental quantum annealer samples ground-state manifolds significantly differently than th

173 ustration and a near degeneracy of different ground states.Materials with a Kitaev spin liquid ground

174 of locality and its restrictions on possible ground states may hold further surprises.

175 led dynamics of the abstraction reactions of ground-state methane (and isotopologues) with atoms (F,

176 Small polaron formation is known to limit ground-state mobilities in metal oxide photocatalysts.

177 ution resulting in negative selection with a ground-state mode against glucose and a subsequent 1,600

178 When a singlet ground-state N,N'-diamidocarbene 1 was photolyzed at 380

179 wering of the Cope barrier and ultimately to ground state neutral homoaromatics.

180 properties of materials with broken symmetry ground states not accessible in equilibrium as vividly d

181 2) , the hollow hexagon concentration in the ground state of 2D boron increases to 1/7 from 1/8 in it

182 The unique triplet ground state of [((R)DDB)Fe(NO)2((*)NO)](+) results from

183 problem, mapped to a problem of finding the ground state of a corresponding Ising spin model.

184 mputing, a system is slowly evolved from the ground state of a simple initial Hamiltonian to a final

185 F interaction and degree of covalency in the ground state of actinide compounds as it is extensively

186 opulations of states that existed within the ground state of apo p27-D2 without changing the barriers

187 sive configurations such as the spin-crystal ground state of artificial kagome dipolar spin ices and

188 Experiments indicate that the ground state of graphene in a strong magnetic field exhi

189 Electrostatic fields tune the ground state of interfaces between complex oxide materia

190 calculations show that even though the bulk ground state of LSMO is ferromagnetic, a large lattice c

191 itialization of the resonator in its quantum ground state of motion and subsequent generation and rea

192 intrinsic challenges imposed by the triplet ground state of O2 and the disparate electron inventorie

193 mouse embryonic stem cells as they exit the ground state of pluripotency.

194 molecular electron transfer/transport in the ground state of radical-anion mixed-valence derivatives

195 SCF/aug-cc-pV(T+d)Z results suggest that the ground state of SiH2OO is severely multireference in nat

196 spectrum of the ortho isomer shows that the ground state of the anion is a triplet, while the quinon

197 The electronic ground state of the Au25(SC8H9)18(-) MPC is described by

198 he identified escape mutations stabilize the ground state of the envelope glycoprotein and should thu

199 state for inhibitor binding rather than the ground state of the enzyme-inhibitor complex, and demons

200 Such problems can be mapped to finding a ground state of the Ising Hamiltonian, thus various phys

201 under ambient conditions for the electronic ground state of the pentacoordinate cobalt nitrosyl comp

202 erization via nonadiabatic relaxation to the ground state of the photoproduct.

203 olution of the computation is encoded in the ground state of the vertex model and its complexity is r

204 absence of EPR signals demonstrate a singlet ground state of the zwitterion, and its calculated geome

205 One might similarly assume that the ground states of charged excitons and biexcitons in thes

206 epresent most physical states, including the ground states of many-body Hamiltonians and states gener

207 y-body states have large, extensive entropy, ground states of reasonable local Hamiltonians carry muc

208 urations with the shallow transient and deep ground states of the Mg acceptor in the Lany-Zunger mode

209 change in the structures and dynamics of the ground states of the mutant proteins.

210 and estimate the radiative lifetimes in the ground states of these "semi-dark" trions and biexcitons

211 e ability of quantum annealers to sample the ground-states of spin glasses differently than thermal s

212 decays back to the planar and linear alkyne ground state on a time scale decreasing from a few hundr

213 rder in the centrifuged glasses reflects the ground state order in the dispersion at lower packing fr

214 +)) = 1.61 V vs NHE], a strong and versatile ground-state oxidant commonly used in organic functional

215 complexes that can cycle through a series of ground-state oxidation levels to achieve a series of dis

216 el non-adiabatic reactions, such as those of ground state oxygen atoms, O((3)P), with unsaturated hyd

217 been predicted using prototype electrostatic ground-state (PEGS) and genetic algorithm (GA) based str

218 ion from the electronic excited-state to the ground-state PES accompanying cis-trans isomerization.

219 hedral complexes based on BeF3(-) that mimic ground-state phosphates; 2) octahedral complexes, primar

220 e-activated intramolecular vibrations of the ground state play a major role in determining the line s

221 Triangulene, the smallest triplet-ground-state polybenzenoid (also known as Clar's hydroca

222 n of molecular structures with crystal field ground states possessing large tunnelling gaps that give

223 it arises from the wavepacket motion on the ground state potential energy surface, which also indica

224 a powerful electron transfer reagent with a ground state potential of -2.16 V vs Fc(+/0).

225 We map out an accurate ab initio ground-state potential energy surface of the K2Rb comple

226 aphene fragments that give rise to high-spin ground states, potentially useful in organic spintronic

227 ed excited species lead to the production of ground-state prebiotic building blocks, principally HCN.

228 ity was promoted through pre-organization of ground-state precursors in ion pairs.

229 e methods provide evidence for an asymmetric ground state present in Bk(IV) that does not strictly ad

230 erestingly, [(eta(1)-I2)BiI5](4-) decayed to ground state products with a first-order rate constant o

231 have been performed to better understand the ground state properties and the photodissociation mechan

232 la: see text] K show that the pseudogap is a ground-state property, independent of the superconductin

233 chain, with four-fold degenerate topological ground state protected by a Haldane gap.

234 potential maps were compared for the TS and ground states, providing the electronic basis for intera

235 ronic transitions could lead to athermal hot ground state reactions and that these might be responsib

236 nsity functional theory calculations for the ground-state reactivity and highly accurate multiconfigu

237 e report transient absorption studies on the ground-state recovery dynamics of the single-molecule fl

238 e destroys the spin and orbitally degenerate ground state, reduces the band gap by 160 meV and renorm

239 ggest that IRPL is generated from excited-to-ground state relaxation within the principal (dosimetry)

240 mpurity embedded in three different magnetic ground states relevant to iron-based superconductors-one

241 and their effects on chemical bonding in the ground states (S0), lowest triplet states (T1), and the

242 Mapping onto the ground-state search problem of the Ising Hamiltonian is

243 Many such problems can be mapped onto ground-state search problems of the Ising model, and var

244 ticity/antiaromaticity, with the switch from ground-state singlet ions to triplet-favored ions result

245 For ground state SO2, this reaction is endothermic and has a

246 m ion and 1-azulenyl oxenium ion are singlet ground-state species with considerable singlet-triplet g

247 s ferromagnetic exchange interactions, large ground state spin values, single-molecule magnetism beha

248 state is 13.5+/-0.5 times stronger than the ground state spin-strain coupling.

249 orkers and the measurement of the zero-field ground-state splitting at the level of seven parts in 10

250 vent effects are discussed in the context of ground-state stabilization and transition-state tunnelin

251 transition-state destabilization rather than ground-state stabilization.

252 are reported with either radical or cationic ground states stabilized by cyclic (alkyl)(amino)carbene

253 The additional introduction of the E64K ground-state stabilizing substitution markedly reduced o

254 The SNP is not predicted to affect the ground state structure of the primary transcript or prec

255 It is found that the ground state structures of small palladium clusters are

256 We observe that RNAs with pseudoknotted ground state structures tend to have more pseudoknotted

257 intermediates than RNAs with pseudoknot-free ground state structures.

258 ramolecular alpha-effect, both in the stable ground-state structures and in the high-energy intermedi

259 Experiment and calculations together reveal ground-state structures that are strongly responsive to

260 Without a ground state substrate-bound structure for the prototypi

261 rges in proximity of other symmetry-breaking ground states, such as antiferromagnetism or charge-dens

262 These unconventional ground states support exotic excitations, for example th

263 nt, in combination, to produce a mesendoderm ground state that can be further programmed into mesoder

264 While in the ground state the FP is high in energy and is unlikely to

265 es for Gln63 rotation were calculated on the ground state, the locally excited state of the flavin, a

266 on (more electrons in excited states than in ground states-the condition for optical gain).

267 Recovery of receptor sensitivity to the ground state then requires dephosphorylation of the rece

268 in these applications is excitation from the ground state to a charge-transfer state; the long charge

269 transition from a disordered, non-magnetic, ground state to a splayed ferromagnetic ground state.

270 onal states and chromatin contexts and set a ground state to allow PRC2 activation by other cellular

271 sult of optical transitions from the neutral ground state to the ionic CT state.

272 eractions can be pivotal not only to enhance ground state toroidicity, but also to develop materials

273 -a-time quantities, in which we identify the ground-state transition (1)S0(1)P1.

274 ctric aluminum nitride exhibits spin-triplet ground states under realistic uni- and bi-axial strain c

275 rystal XRD analysis, we established that the ground state UV-vis absorption of 7 is red-shifted in co

276 staggered magnetization that is close to the ground-state value.

277 vating/switching impacts the recovery of the ground state via charge recombination rates, which diffe

278 ngulene core and verification of the triplet ground state via electron paramagnetic resonance measure

279 he canted antiferromagnetic structure in the ground state, via a pure ferromagnetic structure under t

280 nt confirms the spin-polarized nature of the ground state, which is consistent with the Pfaffian/anti

281 lic compound CuFe2Ge2 has competing magnetic ground states, which are shown to be strongly coupled to

282 while the quinoniminyl radical has a doublet ground state with a doublet-quartet splitting of 35.5 kc

283 between the two generates a Mott-insulating ground state with a peculiar charge-density-wave (CDW) o

284 that are consistent with a singlet diradical ground state with a thermally accessible triplet state f

285 ecule such as CH4 (and isotopologues) in its ground state with a variety of important X radicals such

286 exhibits the much sought-after ferrotoroidic ground state with an enhanced toroidal moment, solely ar

287 The medium-ring products adopt a chiral ground state with an intramolecular, transannular hydrog

288 rated states lead to the repopulation of the ground state with dynamics that are placed in the invert

289 Ti to Ni sites, giving rise to an insulating ground state with orbital polarization and e(g) orbital

290 similar indicating a fragile low temperature ground state with respect to the high temperature one.

291 decays to the latter, which repopulates the ground state with tau = 362 ps.

292 It is shown that the mixing of its ground state with the first triplet excited state, which

293 to greater overlap of the reactant vibronic ground state with the OD vibronic states of the proton a

294 ller than a particular threshold size, but a ground state with topological degeneracy for all system

295 ion and 6-azulenyl oxenium ion have triplet ground states with a singlet-triplet gap of +7 and +10 k

296 ium ions (Ph-O(+)) have closed-shell singlet ground states with large singlet-triplet gaps resulting

297 that BLG is a platform in which topological ground states with possible non-abelian excitations can

298 s that both conformations are sampled on the ground state, with the former thermodynamically favorabl

299 e a rich spectrum compared to the electronic ground state, with the most intense Raman-active modes s

300 st isomerization half-lives adopt a T-shaped ground state Z isomer conformation and proceed through a