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1.
Nanoscale Adv ; 3(14): 4145-4155, 2021 Jul 13.
Article in English | MEDLINE | ID: mdl-36132831

ABSTRACT

Lateral inhomogeneities in the formation of two-dimensional electron gases (2DEG) directly influence their electronic properties. Understanding their origin is an important factor for fundamental interpretations, as well as high quality devices. Here, we studied the local formation of the buried 2DEG at LaAlO3/SrTiO3 (LAO/STO) interfaces grown on STO (100) single crystals with partial TiO2 termination, utilizing in situ conductive atomic force microscopy (c-AFM) and scattering-type scanning near-field optical microscopy (s-SNOM). Using substrates with different degrees of chemical surface termination, we can link the resulting interface chemistry to an inhomogeneous 2DEG formation. In conductivity maps recorded by c-AFM, a significant lack of conductivity is observed at topographic features, indicative of a local SrO/AlO2 interface stacking order, while significant local conductivity can be probed in regions showing TiO2/LaO interface stacking order. These results could be corroborated by s-SNOM, showing a similar contrast distribution in the optical signal which can be linked to the local electronic properties of the material. The results are further complemented by low-temperature conductivity measurements, which show an increasing residual resistance at 5 K with increasing portion of insulating SrO-terminated areas. Therefore, we can correlate the macroscopic electrical behavior of our samples to their nanoscopic structure. Using proper parameters, 2DEG mapping can be carried out without any visible alteration of sample properties, proving c-AFM and s-SNOM to be viable and destruction-free techniques for the identification of local 2DEG formation. Furthermore, applying c-AFM and s-SNOM in this manner opens the exciting prospect to link macroscopic low-temperature transport to its nanoscopic origin.

2.
Phys Rev E ; 102(2-1): 023203, 2020 Aug.
Article in English | MEDLINE | ID: mdl-32942438

ABSTRACT

We consider a quantum multicomponent plasma made with S species of point charged particles interacting via the Coulomb potential. We derive the screened activity series for the pressure in the grand-canonical ensemble within the Feynman-Kac path integral representation of the system in terms of a classical gas of loops. This series is useful for computing equations of state for it is nonperturbative with respect to the strength of the interaction and it involves relatively few diagrams at a given order. The known screened activity series for the particle densities can be recovered by differentiation. The particle densities satisfy local charge neutrality because of a Debye-dressing mechanism of the diagrams in these series. We introduce a new general neutralization prescription, based on this mechanism, for deriving approximate equations of state where consistency with electroneutrality is automatically ensured. This prescription is compared to other ones, including a neutralization scheme inspired by the Lieb-Lebowitz theorem and based on the introduction of (S-1) suitable independent combinations of the activities. Eventually, we briefly argue how the activity series for the pressure, combined with the Debye-dressing prescription, can be used for deriving approximate equations of state at moderate densities, which include the contributions of recombined entities made with three or more particles.

3.
J Chem Phys ; 141(18): 184109, 2014 Nov 14.
Article in English | MEDLINE | ID: mdl-25399134

ABSTRACT

We compute two- and three-body cluster functions that describe contributions of composite entities, like hydrogen atoms, ions H(-), H2(+), and helium atoms, and also charge-charge and atom-charge interactions, to the equation of state of a hydrogen-helium mixture at low density. A cluster function has the structure of a truncated virial coefficient and behaves, at low temperatures, like a usual partition function for the composite entity. Our path integral Monte Carlo calculations use importance sampling to sample efficiently the cluster partition functions even at low temperatures where bound state contributions dominate. We also employ a new and efficient adaptive discretization scheme that allows one not only to eliminate Coulomb divergencies in discretized path integrals, but also to direct the computational effort where particles are close and thus strongly interacting. The numerical results for the two-body function agree with the analytically known quantum second virial coefficient. The three-body cluster functions are compared at low temperatures with familiar partition functions for composite entities.

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