Fig. 2: Operando visualization of the coexisting phases during the structural phase transformation under lithium intercalation. | Nature Communications

Fig. 2: Operando visualization of the coexisting phases during the structural phase transformation under lithium intercalation.

From: Operando real-space imaging of a structural phase transformation in the high-voltage electrode LixNi0.5Mn1.5O4

Fig. 2

ao The 3D strain field inside a single LixNi0.5Mn1.5O4 nanoparticle during the two-phase reaction induced by Li intercalation. The strain maps are extracted by inverting coherent X-ray diffraction data shown in Figs. 1c–j and S4. The semi-transparent isosurface portrays the particle shape, while the colored slices display the strain distribution, ε111(r), on three chosen planes. We show the strain field, ε111(r), as the local lattice constant compared to the average lattice constant, da, of the (111) planes between the fully charged, Li-poor phase (\({d}_{c}=8.00{\text {\AA}}\)) and the partially discharged Li-rich phase (\({d}_{d}=8.10{\rm A}\)), where \({d}_{a}=\left({d}_{c}+{d}_{d}\right)/2=8.05\,{\rm {A}}\) and \({\varepsilon }_{111}\left(r\right)=d\left(r\right)/{d}_{a}-1\). At 0% DoD in a), the particle has a uniform negative strain shown in dark purple, corresponding to the Li-poor phase with a small lattice constant, \({d}_{c}\). At the end of the two-phase reaction around 68.1% DoD in (o), the particle presents a uniform positive strain shown in light yellow, corresponding to the Li-rich phase with a large lattice constant dd. \({Q}_{111}\) points along z.

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