Electronic properties and polaronic dynamics of semi-Dirac system within ladder approximation
Chen-Huan Wu

TL;DR
This paper explores the unique electronic and polaronic behaviors of semi-Dirac systems, analyzing their anisotropic transport properties and impurity dynamics using analytical and numerical methods within a ladder approximation.
Contribution
It provides a detailed theoretical analysis of the electronic properties and polaronic effects in semi-Dirac systems, including new calculations of the pair propagator, self-energy, and spectral function.
Findings
Anisotropic conductivity and transport relaxation rates characterized.
Formation and properties of attractive polarons in semi-Dirac systems elucidated.
Analytical and numerical results agree on polaronic spectral features.
Abstract
We investigate the electronic properties of the semi-Dirac system and its polaronic dynamics when coupled with a fermi bath with quadratic dispersion. The electronic anisotropic transport properties and the semiclassical dynamics of the semi-Dirac system are studied, including the density-of-states, conductivity, transport relaxation rate, specific heat, electrical current denity, and free energy. The attractive polaron formed as the semi-Dirac impurity dressed with the particle-hole excitations in a two-dimensional system are studied both analytically and numerically. The pair propagator, self-energy, spectral function are being detailly calculated and discussed.
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Electronic properties and polaronic dynamics of semi-Dirac system within ladder approximation
Chen-Huan Wu
College of Physics and Electronic Engineering, Northwest Normal University, Lanzhou 730070, China [email protected]
We investigate the electronic properties of the semi-Dirac system and its polaronic dynamics when coupled with a fermi bath with quadratic dispersion. The electronic anisotropic transport properties and the semiclassical dynamics of the semi-Dirac system are studied, including the density-of-states, conductivity, transport relaxation rate, specific heat, electrical current denity, and free energy. The attractive polaron formed as the semi-Dirac impurity dressed with the particle-hole excitations in a two-dimensional system are studied both analytically and numerically. The pair propagator, self-energy, spectral function are being detailly calculated and discussed. The method of medium -matrix approximation (non-self-consistent), which equivalent to the partially dressed interaction vertex by summing over all ladder diagrams, is applied, and compared with some other methods (for many-body problem), like the leading-order expansion (GW approximation), Hartree-Fock theory, and the Nozieres-Schmitt-Rink theory. Since we foucs on the weak-coupling region, the mean-field approximation is also applicable. The polaron properties is related to the anisotropic effective masses of the semi-Dirac system. That’s in contrast to the polarons formed in the surface of normal Dirac systems which has an isotropic dispersion, since the anisotropic dispersion of the semi-Dirac systems results in anisotropic effective mass and anisotropic charge carrier transport. Besides, the symmetry between electron and hole is also broken since the effective masses of the electron and hole are different, which are affected by the polaronic effect when the semi-Dirac material is deposited on a polar substrate, like hBN. The self-localization, short-range potential, and experimental methods as well as the possible formation of the bose polaron on the surface of semi-Dirac system are also discussed in the end. Our results are useful also for the investigation of two/three-dimensional bosonic polaron as well as the polarons in other solid state systems, like the magnetic matter or the topological systems.
1 Introduction
We investigate the electronic properties of semi-Dirac system as well as the related polaronic dynamics as a semi-Dirac quasiparticle (impurity) immersed into a medium (two-dimensional (2D) electron gas). Semi-Dirac 2D material, which exhibits a relativistic dispersion in one direction and nonrelativistic in another, has surge a great research interest[125, 114]. Besides, due to the existence of nonadiabatic feature in the nonrelativistic direction, the polaronic effect would be foud as the minority semi-Dirac quasiparticles interact with the quadratic majority particles (particle-hole excitations) in 2D electron gas. For semi-Dirac system, the electronic transport properties, semiclassical dynamics, and the polaronic dynamics are affected by the anisotropic dispersion, and becomes direction-dependent. To deal with the anisotropicity, we transform the momentum coordinate to the polar coordinate, and apply it into the study of polaron.
The fermionic polaron formed by a mobile light bosonic impurity dressed by the polarized fermions is widely studied in the fermi gases as well as the superfluid quantum state, and the bosonic polaron is also widely explored in Bose-Einstein condensate (BEC)[1, 2] using the method of momentum-resolved radio-frequency (rf) spectroscopy[3], or in a bosonic bath with the induced lattice vibration (distortion) in a solid state system. The repulsive polaron has also been realized by experiments[3, 4, 5] in a BEC. Besides, the scenarios that a fermionic (bosonic) impurity embedded in a fermi (boson) bath (i.e., the fermi-fermi (boson-boson) mixture) are also arouse great interest, like the [6, 7] and the [8] mixures. The formation of the many-body bound state for bose polaron, like the bipolaron and the tripolaron have also been investigated[9, 10, 11, 12, 13]. However, the fermi polaron in the solid state is inverstigated less, but it is also meaningful to study, e.g., in the battery application. We note that, recently, the plasmon-polaron mode formed by a two-dimensional electron gas occupying the surface of topological matter has also been reported in a recent work[14].
Polaron as a dressed quasiparticle is also related to the strength of the interspecies and intraspecies coupling as well as the mean-field energy. In fact, the mean-field approximation overestimates the interaction effect in the strong interacting regime[15], thus the mean-field results also overestimate the critical value of the attractive interaction strength that a stable system begins to collapse, as a phenomenon induced by the quantum pressure. It’s also found that the manipulation of the band dispersion (formed by the free electrons away from the Dirac cone) can used to stabilize the system and change the stability criterial. The spin-orbit coupling is important in stabilizing the collapsed system. Besides, the strength of spin-orbit coupling can be used to manipulating the polaronic effect (like the polaron self-energy) since it’s related directly to the Dirac mass of the Dirac system, expecially in the topological insulators with the intrinsic spin-momentum locking[16, 17, 18, 19]. It’s also found that the modified band dispersion (away from the simple Bogoliubov spectrum by the spin-orbit coupling), can stabilizes the system by counteracting the attractive interactions.
The variational wave function of the Fermi gas system as firstly reported in Ref.[20] is much simpler than the one of the solid state system (see Appendix.A for details). The differences are mainly come from the properties (like interaction effect) of the bath (reservoir of the majority particles) but ont the center mobile quantum impurity. By taking the intraspecies coupling into consideration, we can obtain a more accurate result for the polaron in the solid state system. That also directly revealed in the formula of the bare coupling parameter (see text) which contains the bandwidth factor in the denominator (see text) (while in the vacuum limit with , the bandwidth is nearly zero, e.g., the molecule whose binding energy equals to the center-of-mass kinetic energy[21]). The formation of the polaron (or even the trion) and the polariton have been realized in semiconductor heterostructure by using the technique of cavity coupling in the presence of exciton-electron interactions[22, 23]. For semi-Dirac system, which has very interesting electronic and topological properties under irradiation[24, 25, 26], although its anisotropic dispersion, we can still approximate it as the one similar to the two-dimensional electron gas when the carrier density is just slightly larger than the band gap () and with small momentum. In the mean time, the chemical potential of the impurity can be treated as a negative unphysical parameter during the calculation of the polaron energy (i.e., the pole of the dressed Green’s function). As a quasiparticle, the attractive polaron is metastable as directly seen from the spectral function as well as the effective mass and quasiparticle residue, that also revealed by its complex energy as obtained by the diagrammatic method within ladder approximation, and such result is also in agreement with the one in Ref.[22].
In Sec.2, we present the model and the related electronic quantities of the semi-Dirac system. In Sec.3, we discuss the semiclassical dynamics. In Sec.4, we study the polaronic effects in terms of the anisotropic and isotropic treatments. In Sec.5, we discuss the negative gap case. In Sec.6, we discuss the remained Coulomb interaction effect in the prsence of low carrier-density approximation. In the end of this article, we also present a detail discussion of the theoretical framework about the Chevy-type variational wave function within ladder approximation (Appendox.A), and the possible self-localization as well as the short-range (but not zero) potential (Appendix.B). In Appendix.C, we present the experimental method which is possible to demonstrate our theories, and discuss the possible realization of the bose polaron for semi-Dirac system deposited on a polar substrate.
We note that, in this paper, we mainly focus on the zero temperature case (or the low-temperature limit), and using the non-self-consistent -matrix theory which provides a more accurate polaron energy estimation than the self-consistent one[124] due to the cancelling effect of the higher order multi-particle-hole excitations[120]. Besides, during the calculation of polaronic dynamics-related quantities, we mainly consider the motion of impuirty (or polaron) in the nonadiabatic direction (-direction), no matter in anisotropic or isotropic treatments.
2 Model
We consider a model that the semi-Dirac impurity interact attractively with the excitations in a fermion bath (free 2D electron gas). Unlike the point fermi surface aspect in zero gap intrinsic materials, we set the finite fermi energy (chemical potential in noninteracting case) for the quasiparticles in semi-Dirac material during the evolution of energy spectrum. Thus the Landau damping (or Beliaev damping), due to the pairing interaction effect (or fermi surface effect), emerges, and it exists as long as the interaction between impurity particle and the majority one is nonzero. Also, the existence of chemical potential leads to the screening to the long-range Coulomb potential, thus we can assume the contact potential (interspecies) is dominating in our model, and due to the short-range nature, the anisotropy of interaction can be ignored. We note that, while in the limit of zero doping, the ratio of Coulomb energy to the kinetic energy is largely increased[82], and the orbital susceptibility and fermi surface orbiting frequency will diverge[81].
At zero-temperature limit, the summation over Matsubara frequencies can be replaced by the integrals over the continuous frequencies, which can be measured from the quasiparticle dispersion as well as the self-energy[36]. And in single impurity case, the intervalley scattering does not have to be taken into account. For the Fermionic reservoir, we apply the semi-Dirac model with the merging Dirac points in order to containing both the linear Dirac dispersion and the effective mass (hopping). The phases of the semi-Dirac system is dependent on the Dirac-mass : for positive , the system is in insulator phase, while for negative , the system is in semimetal phase, which is in contrast to the usual phase transition to a metal due to the disorder (like the Coulomb interaction) [37]. The evolution of the dispersion with phase is shown in Fig.1.
We assume the number-density of the semi-Dirac quasiparticle is much lower than that from fermi bath, thus we regard the former as the impurity, while the latter as the majority component. Then Hamiltonian of such mixture reads
[TABLE]
where is the bare (unrenormalized) contact interaction. The Hamiltonian of the quasiparticle in doped 2D semi-Dirac system reads
[TABLE]
and the Hamiltonian of isotropic majority component (electron-hole pair excited by the semi-Dirac quasiparticle) reads
[TABLE]
The Dirac mass[111, 112] term here reads where is the band gap. For zero momentum and zero magnetic field, . The matrix form of reads
[TABLE]
with the eigenenergy
[TABLE]
To dealing with the anisotropic dispersion of the semi-Dirac quasiparticle, we use the following substitution,
[TABLE]
where is the unit momentum which of the order of ( is the lattice constant). . During the following integrating process, the maximum value of is for and for and . is the velocity along the -direction with the hopping in -direction. Note that the approximation in third line is valid for negative , while that in the last line is valid only at small momentum with positive . Base on the above two equations, we obtain the band velocity as
[TABLE]
The above hamiltonian matrix can be transformed to
[TABLE]
whose eigenenergy reads and the corresponding spinor part of eigenvector can be written as
[TABLE]
Then through the Jacobian transformation, we have
[TABLE]
where we define . Then base on the bare Green’s function , the electronic denisty of states (DOS), which is an essential quantity for nanosystems, can be obtained as
[TABLE]
where is the Heaviside step function. Note that the upper (lower) sign corresponds to the positive (negative) impurity energy. The factor is related to the complete elliptic integrals of the first kind . For positive gap (insulating phase),
[TABLE]
For negative gap (energy offset) with ,
[TABLE]
While for the case that the initial momentum of impurity is along the -direction, i.e., , the DOS can be obained as
[TABLE]
Through further calculation, we will find that the DOS of impurity whose initial direction (before scattering) is along the -axis (contributes to the formation of polaron) is much smaller than the case when the initial direction is closes to the -axis (e.g., ). For different initial polar angle and Dirac mass, the DOSs are ploted in Fig.2, and compared to the result obtained by integrating all the possible (blue line; see Eq.(12)). It is obvious that the DOSs have , that is different from the results obtained by low-density approximation as presented below. Also, we found that the DOS is linear with energy in region.
Since the fermi wave vector is the same for both the parabolic and linear dispersions[97], we can savely write the of semi-Dirac system as (ignore the degenerate parameter 4 here)
[TABLE]
Thus the fermi momentum has . In low carrier density limit, , where is the effective Bohr radius in direction and is the dielectric constant, and that can be realized by turning up the value of . We note that, in perspective of polaron in weak coupling regime, the fermi wave vector can also be written as .
At low-temperature, the specific heat of semi-Dirac system can be obtained by the DOS, which reads (averaging over energy)
[TABLE]
and the specific heat of polaron can be obtained just by replacing the DOS with the polaron one. In low carrier density approximation where the DOS is independent of the quasiparticle energy (see below) in the region of , the above equation becomes
[TABLE]
The result of in low carrier density approximation is shown in Fig.3 (black line).
In the perspective of temperature-depenent free energy, the specific heat of semi-Dirac system can also be written as
[TABLE]
where the free energy reads
[TABLE]
where denotes the energy-cutoff. Since it is necessary to guarantees the term within the square bracket of above expression is positive, we apply the eigenvalue of valence band which with negative energe, then the free energy can be obtained as
[TABLE]
According to the low carry-density approximation as will presented below, the free energy can be obtained as, for ,
[TABLE]
After subtracting the temperature-independent part of free energy
[TABLE]
Then the specific heat is easy to obtained through Eq.(19). As presented in Fig.3 (blue line), unlike the specific heat calculated above, we found that below a certain threshold temperature there is no notable value of specific heat. Note that when the polaronic effects are taken into account, the bare Green’s function within above expression should be replaced by the dressed one . The result of in perspective of temperature-dependent free energy is shown in Fig. (blue line). By comparison, we see that the in perspective of temperature-dependent free energy is zero at low-enough temperature, while that in the low carier density approximation is linear with temperature at the begining and last for a finite range of , and both of these two curves converge to a finite nonzero constant in the high-temperature limit.
At high temperature, the specific heat of semi-Dirac system at critical point is the same as that of the normal 3D electron gas, i.e., , according to equipartition theorem. Unlike both the high-temperature and low-temperature limit, the low temperature heat capacity[81] per semi-Dirac particle is linear with the , where for integral over the from 0 to as shown in the formula of DOS in above, and is the scaling constant of energy.
3 semiclassical dynamics
Then the semiclassical conductivity of semi-Dirac quasiparticle can be obtained through the Einstein relation . is the diffusion coefficient which can be obtained through the autocorrelation function
[TABLE]
with the relaxation time and the number of impurity paritlce. For short-enough relaxation time, and with , we can approximately obtain
[TABLE]
where is the anisotropic in-plane velocity. Since we focus on the -direction nonrelativistic momentum of the semi-Dirac particle, the longitudinal conductivity can be obtained as
[TABLE]
Note that while for conductivity at fermi energy, it reads .
To obtain the conductivity of polaron, the DOS and relaxation time must be replaced by the polaron ones, and the band velocity and must be evaluated from the polaron dispersion (modified by the self-energy effect). For polaron formation, the transport scattering time at zero temperature reads (we assume both the excited electron and impurity are above the fermi surface, as evidented by Eq.(40))
[TABLE]
where is the Dirac- function, and denotes the absolute value. Note that the scattering time here is unrelated to the Landau damping due to the zero-temperature limit. Also, we note that the particle-particle scattering amplitude is independent of temperature in such limit. In fact, the formula in above is different with both the Beliaev damping and Laudau damping[104, 105] due to the existence of impurity frequency term (before scattering) within the -function. But when the thermal excitations are considered (like the positive band gap in insulator phase), the Laudau damping is possible as the momentum of polaron damping back to . While the Beliaev damping requires the energy conservation and mainly happen for .
From this Dirca- function, we can easily know that the scattering here is inelastic since the energy of impurity changed by the scattering. denotes the maximum value of the possible which depends on the value of . The above expression, in the case of large , is valid under the condition and . Note that here we assume the hole is static with , and we ignore approximately apply , which ignores the effect of angle between and scattering wave vector : can be obatined by the relation . This transport scattering time is different from the single particle relaxation time because it is related to the pairing scattering as well as the scattering wave vector. When consider the effect of finite temperature, the transport scattering time reads
[TABLE]
where we still assume , and in second line we use the relation which is correct in large and region as well as the low-temperature case. and denotes the total number of impurity particles and the number of unit cells, respectively. Note that the here is equilibrium Fermi-Dirac distribution function, i.e., without affected by the effective electric field and thus [91, 92].
The above transport scattering time satisfy the linearized Boltzmann transport equation
[TABLE]
where we define the group velocity (band velocity) vector as and the approximation in last two lines we apply the relation . We write the scattering rate in Born approximation as
[TABLE]
and for inelastic scattering the detailed balance[88, 89] should be obeyed. Through the above expression, we can also obtain
[TABLE]
In the presence of external potential which can be expressed in a electric field form (), the time derivative of the nonequilibrium distribution function reads
[TABLE]
and the dc transport of electrical currents can be obtained as
[TABLE]
where here is the angle between directions of electrin field and electrical current. The electrical currents can be related to the dc conductivity as
[TABLE]
where we also have , , and . The dc conductivity presented here is also consistent wih the result[101] where is the mean-free path in semiclassical limit and is in agree with the Eq.(16).
To study the Hall current, we can apply the static electric field along -direction, which will leads to Hall current with the plane wave solution of Hamiltonian Eq.(3) ( can be treated invariant here), and that also related to the Hall transition conductivity (in real space) by the Wick’s theorem
[TABLE]
where corresponds to the energy induced by the electric field, and the effect of
The Hall conductivity at finite temperature can also be obtained by the Kubo formula
[TABLE]
where the velocity matrices reads Here is the spectral density matrix which is related to the matrix of Green’s function by . Note that we assume the effect of electric field provides a photon-like energy and leads to a vertical transition in the dispersion (with zero relativa momentum).
Note that the spectral function reads
[TABLE]
and for nonzero spectral function, the above formula can be reduced to
[TABLE]
where and is the Matsubara frequency. In terms of the sum over scattering states, the imaginary part of Green’s function can also be expressed as , where denote the quantum states in valence band and conduction band, respectively. Through this relation, the conductivity can also be expressed by the response of current to the vector potential: [90, 106, 107]
[TABLE]
Note that, since we consider the finite chemical potential, the interband transition has a gap as large as (for monolayer) due to the Pauli blocking, and thus the vertical transition requires , while the intraband transition with a Drude peak in zero limit of .
The broadened spectral function due to the quasiparticle scattering rate can be expressed by the Lorentzian representation where and where is the transport scattering rate amd is the quasiparticle scattering rate.
4 Polaronic effects: pair propagator and self-energy
4.1 Potential and the polaronic interspecies coupling
We consider the contact interaction (zero-range potential) within the environment with low fermi-energy and fermi wave vector[27], like the -type impurity field, which can also be replaced by the Gaussian broadening (due to the scattering effect at finite temperature, like the cases with thermal de Broglie wavelength). This broadening is more observable in the solid state like the Dirac/Weyl systems, as evidened by the measured conductivity as well as the resonance spectrum. Due to the presence of short-range interaction (as widely observed in the low-density regime of the fermi gases), the long-range Coulomb potential as well as the frozen ripple scattering is reduced, while the resonance scattering is more dominating as in presence of, e.g., the ion irradiation[28] (resonance impurity). Even in the absence of artificial irradiation, the scattering mechanism analogous to the Fano-Feshbach resonance is possible in the solid state systems base on the virtual transition as discussed in the graphene[29]. The impurity effect and the related electronic transport can be detected by the resonance scattering, which means that the -wave scattering length can also be used in our calculation for the solid state (Dirac) systems. And since we ignore the resonance scattering effect, the interspecies scattering length can be referred to the background scattering length.
For zero-range model in mean-field approximation, the inversed interspecies coupling and the pair propagator are ultraviolet divergent (restricted by a momentum cutoff scale ), in the absence of the renormalization-term—. The resonance scattering is detectable in the vacancies of the lattice system, where the on-site potential is infinitely strong and with the divergent scattering length [30], that means the scattering length is of the order of inversed potential range , similar to the momentum cutoff . That can also easily be verified numberically that, the propagation of the traveling plane wave state (in momentum space) will destroyed by the strong on-site potential of a single vacancy, except when there is a strong enough interspecies interaction (between the particles with opposite spins) which with a longer scattering length than the on-site impurity one. That will be particularly obvious for the Anderson localization with the disordered media[31]. These are different to the cases where the long-range interactions are taken into consideration and play a main role[32]. For the bare interspecies coupling constant is bound to in the zero-range limit (the negative sign is due to the attractive interaction), that can be easily obtained from its expression,
[TABLE]
which becomes after the renormalization which is also the result obtained by the first-order Born approximation for the low-energy collision[33]. here due to the attractive interaction and with the negative -wave scattering length (like the fermionic )[34].
4.2 anisotropic treatment
Similar to the procedure as we carried in Ref.[87], we consider the chiral effect into the pairing scattering event: an electron-hole pair (electron with momentum and hole with momentum ) is excited in the fermi bath by the chiral semi-Dirac quasiparticle which with initial momentum and final momentum . The non-self-consistent -matrix theory takes into account the higher-order pairing fluctuation than the Gaussian fluctuation[74], although the propagators of the two quasiparticle excitation are bare. Then the pair propagator can be written as
[TABLE]
Since the semi-Dirac quasiparticle is anisotropic which with relativistic behavior in -direction and non-relativistic behavior in -direction. Obviously, the quadratic dispersion in -direction with nonadiabatic feature (lower velocity compare to the relativistic one) gives the mainly contribution to the formation of polaron, i.e., the interaction between the momentum of electron-hole pair and the -direction momentum of impurity is much stronger than the -direction one, thus for the impurity term in above equation, we only integral over the -direction momentum. Note that while for the excited electron-hole pair, we suppose it as isotropic in momentum space. We continue to use the substitutions
[TABLE]
Note that and when . The chiral factor reads
[TABLE]
where denotes the initial state of electron-hole pair beforce scattering (there is not initial occupation in mode ) but we assume the excited electron-hole pair is along the initial direction and thus . This chiral form factor shows that the interaction vertex during the pairing scattering is dependent on both the initial momentum and scattering wave vector , similar feature can be found in some other models with electron-phonon interaction[75, 76, 77], while in the absence of such kind of transition matrix element (between initial state and excited state), the interaction term becomes dependent only on the scattering wave vector, like in Refs.[22, 78, 21]. As we mentioned above, the Landau damping (as a conjugate process of the Beliaev coupling) here is related to the value of scattering wave vector or [79, 80], i.e., in long-wavelength limit with (or in the strong coupling limit), the damping vanishes due to the destructive quantum interference. At finite temperature, the Landau damping of polaron here is easy to recognized as the process that the polaron decays into two modes: . Note that the destructive quantum interference can be destroyed by the adiabatic dynamics, e.g., the linear dispersion (gapless) in -direction of the semi-Dirac system. In adiabatic limit, the superposition of impurity state and the majority one will turns into the statistical mixture. While in the nonadiabatic case, the quantum interference patterns exist and the superposition between states can be ensured by the equal masses between impurity and majority particles. In this case, the behavior of dissipationless flow (in superfluid phase) can be observed in a Bose gas[79] where the interactions support the linear dispersion in low-momentum region, unlike the Dirac system which owns linear dispersion in low-momentum region in noninteracting case. Due to the interaction effect, the transport of polaron in -direction will not be ballistic, and the momentum will not conserved during the transport. Also, in the non-spin-degenerate case, the spin polarization is possible to produced by the electric field-driven acceleration of electrons unlike the adiabatic case[93].
In this paper, we mainly focus on the nonadiabatic case. In momentum space, the above chiral factor can also be rewritten as
[TABLE]
The final expression of the pair propagator at zero temperature reads
[TABLE]
where . . Note that unlike the calculation of DOS, we set a momentum cutoff the upper limit of integral over to prevent the problem of inconvergence, as we presented previously in Ref.[87]. Similar to the above transport scattering time, we here only consider the contribution from -component of momentum of semi-Dirac quasiparticle but consider all components of momentum of the majority particle, i.e., the nonrelativistic parts. The results are presented in Fig.5-7. The nonanalyticity are obvious in pair-propagator and self-energy due to the logarithmic divergence. We note that the integral over scattered impurity wave vector can savely be replaced by the integral over the scattering wave vector in any cases. Thus for scattered semi-Dirac quasiparticle (polaron), the DOS (at semi-Dirac phase) can be obtained by the expression
[TABLE]
The above-mentioned polaron band velocity (after pairing scattering) can then be obtained as
[TABLE]
where the polaron energy, unlike the above mentioned bare energy of semi-Dirac quasiparticle, reads . here the polaronic effect induced self-energy can be obtained as
[TABLE]
where is the coupling constant obtained by integrating over the momentum (not the relative (transfer) momentum and the center-of-mass momentum). Note that at low impurity density limit (), the transfer momentum-dependence of the interaction term can usually be neglected[115, 22], i.e., the can be treated approximated as -independent. While for large transfer momentum, e.g., , the Kohn anomaly appears only in the presence of spin (or pseudospin) splitting[119], and the polarization bubble (not the pair-scattering one) in second order diagram (to second order of the nonlocal interaction ) behaviors as where is the transferred momentum of the impurity and is the transferred energy. Note that here the dynamical polarization is analytic (does not contains the logarithmic term), which implies that the nonanalyticities from both the small region and (with backscattering due to the weak coupling) Landau damping are neglected. While the logarithmic divergence bringed by the Landau damping with thermal excitations has a cutoff at energy , unlike the configuration we discussed above which has a cutoff at energy of the order of impurity bandwidth. The pair propagator, self-energy, and spectral function are presented in Figs. for insulator phase (; solid lines) and semi-Dirac phase (; dashed lines). The spectral function shift rightward with the turning up of Dirac mass term, and we can also see that the removing a fast impurity will cost larger energy . For stronger coupling , this energy cost will descrases.
Through the above-mentioned formulas we have
[TABLE]
For semiclassical case, as stated above, the product of and can be used directly to obtain the semiclassical conductivity. While for the quantum-like conductivity, the product of and should be replaced by the product of their respective matrix elements and , i.e., containing the effect of wave function overlap[90].
It is obvious that the free energy calculated above is the noninteracting result, we now take the polaronic coupling into account. To containing the interaction effect, the free energy can be rewritten as[116]
[TABLE]
where is the grand canonical potential (thermodynamic potential) which reads
[TABLE]
is the first-order interaction correction to the grand canonical potential which shows that the interaction effect can be contained even just consider the bare Green’s function. is the temperature-dependent chemical potential, which can be obtained by solving where is the DOS at finite temperature. The concentration can also be related to the Green’s function at finite temperature by , or related to the chemical potential by (or ) where we ignore the residual polaron-polaron interaction. The calculated results shows that, at finite temperature, even the noninteracting grand canonical potential diverges from the simple result[117, 115] , and becomes rather complex for the semi-Dirac system especially when the polaronic effect is taken into account. The polaronic interaction will decreases the grand canonical potential, although it can be neglected if the coupling is weak enough. The impurity density here is also temperature-dependent, , which implies that for small impurity density, it is more easy to adjust the chemical potential by gating. Note that the relation between the eigenenergy (or the excited quasiparticle energy) and the grand canonical potential can be obtained by the thermodynamic Bethe Ansatz equation for equilibrium states[118].
4.3 Conductivity
Base on the Kubo formula, the real part of conductivity in dc-limit can also be written as
[TABLE]
where the current-current correlation reads
[TABLE]
Temporally ignore the contribution from the polaronic attractive interaction-assisted hopping to the conductivity, the Hall conductivity at finite temperature can be written by the Kubo formula as presented above
[TABLE]
where the nondiagonal elements of the new velocity matrices in coordinate reads
[TABLE]
Then the matrix elements reads
[TABLE]
The spectral density matrix reads
[TABLE]
In contrast with the diffusion one, the hopping conductivity which requires finite temperature reads, for low-temperature limit,
[TABLE]
The relation () is used here. We can see that the transfer matrix element (expectation value of velocity operator) only between the states with same energy, but when the polaronic attraction is taken into account, the hopping between donor impurity states with different energies becomes possible, as evidented in the systems with slow phonons[108, 109], and the conductivity then has (consider the hopping only in -direction)
[TABLE]
where is the resonance integral which can be proved proportional to the coupling constant here through the polaron canonical transformation[110]. is the distance between hopping sites in real space.
We note that unlike the isotropic system (e.g., with the crystal symmetry) where [90], the longitudianl optical conductivities in semi-Dirac system has , [114].
4.4 isotropic treatment: low carrier-density approximation
For the case that the chemical potential lies within the conduction band but with low-enough carrier density[125, 85, 86], the dispersion of semi-Dirac quasiparticle can be treated isotropic but with different effective masses in different direction, which leads to the Hamiltonian
[TABLE]
and the spectrum reads
[TABLE]
where the approximation in second line is valid for small and . Note that due to the low carrier concentration, the polaron-polaron interaction, which is short ranged, can be neglected. Then it is useful for us to carry the following coordinate transformation
[TABLE]
where and . Then similar to the above procedure, we can write the Hamiltonian as
[TABLE]
thus we can obtain the eigenenergy . The Jacobian transformation reads
[TABLE]
Then the DOS can be obtained as
[TABLE]
It is easy to find that, unlike the result obtained base on anisotropic model as shown above, the DOS obtained in low-density approximation is independent of energy in some certain region: for upper branch, nonzero constant DOS requires , while for lower branch, nonzero constant DOS requires . This is different to both the intrinsic Dirac systems (or some other graphene-related complex junction structures[94, 100]) which has a DOS linear with energy in low-energy regime[97, 92], and the semi-Dirac systems whose DOS is proportional to as we stated above. Such special phenomenon in DOS (constant, but not follow the power law behavior) is similar to the normal 2D electron gas, and can also be found in the bilayer graphene[98, 113] or other bilayer Dirac-like systems under magnetic field[99, 114] (if we ignore the largest peak in zero energy which is contributed by a doubly degenerated level). That also implies in low carrier density approximation the semi-Dirac system can be approximately treated as 2D electron gas although with different effective masses in different directions. For constant DOS, the noninteracting fermi energy could also be a constant as . Note that since here, the fermi momentum could be very small.
Base on above formulas, we can make the substitute when integral over the momentu
[TABLE]
where for the electron within electron-hole pair in 2D electron gas, the isotropic momentum (with ) has and . Note that the momentum of scattered impurity also contains a which is anisotropic. Due to the trigonometric functions in the denominator, it is inconvenient to calculate the pair propagator and self-energy, thus we make the further substitution
[TABLE]
where and then we have . The approximation in the second line of above expression can be applied only for large . Although such approximation will still induces an error as large as about 36, it is in fact does not matter since the momentum does not have much to do with the polaronic dynamics. Since in isotropic case , we have which is also used in Eq.(23).
Consider the pairing scattering, the pair propagator reads
[TABLE]
By simply setting , i.e., for polaron moves along direction, we obtain the pair propagator, self-enery, and spectral function as shown in the Figs.8-10. The time-reversal symmetry is broken as can be seen from spectral function, and the damping is smaller compared to the anisotropic solutions.
Similar to the above procedure, the Hall conductivity can be obtained as
[TABLE]
with the Hamiltonian
[TABLE]
and thus the velocity matrices read
[TABLE]
and the matrix elements read
[TABLE]
The sign depends on the quantum states and .
4.5 Other polaronic-effect-related quantities
When the center-of-mass momentum is zero, the attractive polaron is in ground state[4] and with negative energy. The expression of the pair propagator is similar to the dynamical polarization induced by the charge carriers in the absence of the bare scalar potential, and the Coulomb interaction here is screened by the particle-hole excitations. Then the -matrix can be obtained as
[TABLE]
where is the renormalized interspecies coupling parameter (independent of the ultraviolet cutoff) and it’s reminiscent of the interspecies vacuum scattering matrix (in weak coupling case). Note that this -matrix is the single channel one with the back ground scattering length, while two body interaction in close channel acts like as a molecule[43]. The diagram representation of the -matrix and self-energy are shown in Fig.11. The -matrix here is equivalent to the partially dressed interaction vertex (by summing over all ladder diagrams). Since the interspecies coupling is weak and invariant in our model, it won’t dynamically induce the intraspecies (between the majority particles) coupling unlike the case of impurity with infinite mass[44]. Note that for zero-range limit, the -matrix need to be replaced by the bare coupling parameter[45]. Diagrammatically, the above non-self consistent medium -matrix can be described by the Bethe-Salpeter equation, with both the bare impurity propagator and bare majority propagator:
[TABLE]
where is the bare impurity-majority interaction. The electron momentum are treated as the relative momentum here. and are the bare Fermionic and Bosonic Green’s function, respectively. is the chemical potential of the impurity which can be approximated as the zero-momentum polaron self-energy in the adiabatic limit . Since , such negative chemical potential can be used in computation and analysis[33, 46] to reflects the perturbation of a single impurity to the surrounding majority particles, but it is indeed a unphysical free parameter as obviously. Thus the can be setted as zero when this perturbation effect can be ignored[43]. The as an incoming energy momenta can be omitted, but we retain it here for the integrity of the equation. In the absence of the center-of-mass momentum () and the energies, the Bethe-Salpeter equation becomes the Lippmann-Schwinger equation (for the two-body problem)
[TABLE]
Base on the calculated medium -matrix, the polaron self-energy at zero-temperature can then obtained as
[TABLE]
Unlike the fermi gas with nonnegligible finite density, the fermionic reservoir in a semi-Dirac system contains only the two-body scattering and without the many-body scattering. While at finite temperature, it reads
[TABLE]
At Ref.[87], we have proved that, at temperature , where is the Fermi temperature, the polaron self-energy decreases with the increase of temperature, and the variation of self-energy due to the temperture effect, which is an order of magnitude less than the one due to the variation of momentum of energy, also decreases with the increase of temperature, which is in agreement with Ref.[124]. Beyond this temperature range, higher temperature may supresses the polaronic effect.
Containing the fermi liquid renormalization effect, the Green’s function can be rewritten as where is the real part of polaron energy (after fermi liquid renormalization) determined self-consistently by the equation . By setting the vanishing hole momentum [120, 47] (in low-momentum limit of the semi-Dirac fermions with the approximated dispersion shown above), the polaron self-energy at zero-temperature limit (and one particle-hole approximation) and the quasiparticle weight can be obtained as
[TABLE]
respectively. The quasiparticle residue for a well defined impurity can be obtained by the long-(imaginary)time behavior of the impurity Green’s function, and then the residue can be obtained by the Chevy wave function’s coefficient (as presented in Appendix. A)
[TABLE]
with . In terms of momentum distribution function, the residue has the following relation
[TABLE]
For frequency-independent self-energy, i.e., static impurity, the residue becomes and the fermi liquid renormalization (many-body correction) vanishes, which meets with the RPA result. The polaronic effect-induced effective mass can be directly obtained through the relation
[TABLE]
In terms of the fermi-liquid form with the finite chemical potentials determined by the relation about propagator , the effective mass can be represented as
[TABLE]
The results are shown in Fig.12. The stable region and unstable region locate on the large (or ) and small (or ) regions, respectively, and the instability is related to the only. Note that here we apply the isotropic approximated as discussed above, and thus the self-consistented energy is dependent on the magnitude of only. Further, we note that for nonadiabatic case (nonrelativistic impurity electron), the decoherence process driven by impurity-bath interaction[123] (which can also be induced by the phonon dissipation[121] or the inequivalent masses[122]) is important to the formation of polaron.
5 Negative gap with merging Dirac cones
As we stated above, the transport of semi-Dirac particle along -direction is nonadiabatic. During the propagation along the direction (), for (), the eigenstate of semi-Dirac particle becomes propagating, while for , the eigenstate becomes evanescent[95] (although is also suitable for the evanescent mode, but it is in fact impossible since the needs to be negative in this case). That is in contrast with the case of positive gap () which is dominated by the adiabatic processes for intrinsic (without the polaronic interactions) semi-Dirac system. For the case of positive gap, during the quantum tunneling like the junction structure or transport across a potential, the spinor eigenstates are propagating for energy larger than an energy threshold[94, 96], while they are evanescent for energy lower than an energy threshold. This energy threshold is dependent of momentum , and The reason for this difference is due to the stronger interaction effect in the band crossing region. Through above analysis, we can know that, for anisotropic model, the represents propagating and evanescent modes exist for and , respectively; for isotropic case (in low carrier-density approximation), the represents propagating and evanescent modes exist for and , respectively. Note that although the semi-Dirac system can be described by the continuum model in low-energy limit with small enough lattie constant, it is usual studied by using the Schrodinger equation[95, 81] but not the Dirac equation.
We ignore the intraspecies interaction (i.e., the interaction between identical fermions) here since we consider the -wave interaction in low-energy case with the Pauli exclusion. Thus the three-body Efimov effect is also neglected here. For merging Dirac cones, the above Hamiltonians are still applicable and we just need to change to . We note the dispersion here has time-reversal symmetry () and particle-hole symmetry even when the irradiation (the non-resonance one, which with smaller frequency and larger coupling than the resonance one) is applied, besides, the irradiation cannot open a gap to the Floquet quasienergy spectrum even in the high frequency limit when [24].
For negative gap , the induced two new Dirac points arrange in -direction and locate on , which shows the time-reversal symmetry and reflection symmetry. These two Dirac points can be viewed as the topological defects in band structure. The Berry phases of two Dirac points also support the stability against with the lattice perturbation[102]. The relative phase of semi-Dirac system in anisotropic or iostropic treatments are shown in Fig.13. Note that here the perturbation does not includes the lattice potential[103], since the adiabatic dynamics is still dominated in the presence of Dirac cones and thus the electron trajectories are still constrained by the Bragg reflections.
Besides, the interparticle spacing closes to the mean-free path of the mobile impurity as required by the formation of polaron [41, 42].
6 Coulomb interaction and induced self-energy
Due to the low carrier density as mentioned above in this model, the long-range Coulomb interaction can also be taken into account, althought it’s partly dynamically screened as evidented by the frequency and momentum dependence of the polarization and the Dyson function. That results in a Coulomb-interaction induced exchange self-energy of the semi-Dirac fermions (around the impurity). The particle polaron is more common unless the Coulomb interaction is strong[13]. The Coulomb interaction as well as the spin-correlation enhance the self-localization of the polaronic carriers, and thus narrow the bandwidth (thus the ground state energy of free-electron is enhanced) and affect the band dispersion away from the Dirac-point. In fact such self-localization (self-trapping) can not be found in the model we discuss here, except when the phonons are excited by the bath and interact with the electron (form the so-called Bose polaron) with the strong Coulomb interaction.
The Coulomb-induced exchange self-energy to the leading-order expansion reads
[TABLE]
where the dressed Coulomb interaction reads
[TABLE]
The fermions dynamical polarization here is required by the GW approximation which with the random phase approximation (RPA) screening effect. The fermion flavors can be simply choosed as the spin degrees of freedom () contained within the Dirac-mass term. But for (two-band model), the expansion is equivalent to the Nozieres-Schmitt-Rink method[50]. While for the Hartree-Fock (mean-field) approxination, the dressed Coulomb interaction term should be replaced by bare one. Compared to the above expression of the polaron self-energy, it is interesting to compare the here to the -matrix. Although they all contain the ultraviolet physics as well as the RPA screening effect, the scattering -matrix (or the sum of the ladder diagrams) takes into account the -wave scattering length, while the RPA ignores the ladder diagrams. If the interspecies interaction changes to zero, the full polarization becomes simply the overlap of the impurity and majority particle, and we can expect that the polarization has two distinct peaks in such case, contributed by the two components respectively. Further, when consider the perturbation effect, the Hartree term with bare attractive interaction should be contained in the self-energy[51].
7 Conclusions
In this paper, we apply the method of medium -matrix approximation (non-self-consistent) to investigate the properties of the attractive fermi polaron formed by a mobile impurity immersed to the fermi bath of the 2D semi-Dirac system. The polaronic dynamics-related quantities, like the pair propagator, self-energy, spectral function, effective mass, and quasiparticle residue, are calculated and analyzed. The -matrix approximation is equivalent to the partially dressed interaction vertex by summing over all ladder diagrams. The leading-order expansion (GW approximation), Hartree-Fock theory, and Nozieres-Schmitt-Rink theory are also mentioned and compared to the -matrix approximation. As revealed by the expression of the -matrix given above, the polaron properties is related to the effective masses and even in the isotropic treatment. The effect of gap are also revealed. That’s in contrast to the bose polarons formed in the surface of normal Dirac systems which with isotropic dispersion, since the anisotropic dispersion of the semi-Dirac systems results in anisotropic effective mass and anisotropic charge carrier transport. Besides, the symmetry between electron and hole is also broken since the effective masses of the electron and hole are different. Here the effective masses are affected by the polaronic effect when the semi-Dirac material is deposited on the polar substrate, like hBN. Our results are useful also for the investigation of two/three-dimensional (since the diagram topologies in two- and three-dimension are similar[46]) bosonic polaron as well as the polarons in other solid state systems, like the topological systems where the nontrivial topological properties of the bath and the chirality should be taken into account additionally.
8 Appendix
8.1 A: Polaron wave function and the variational ansatz
In the absence of the spin-rotation (due to the -type impurity field), the Chevy-type variational ansatz for a mobile Bosonic impurity with momentum dressed by one electron-hole pairs (excitations) is
[TABLE]
where is the group state of majority particles. is the creation operator of the excited particle with momentum , and is the the annihilate operator of the hole at momentum . Here is for ensures the particles are excited out of the Fermi surface.
We write the polaron Hamiltonian in a continuum model as (omits the arrows in the subscript)
[TABLE]
The arrow attractive contact interaction here also can be referred to the scattering strength for the impurity/majority particle with momentum scattering to a particle state with momentum through the scattering momentum (the hole momentum), which can be approximately defined in low-density case (and in a many-body system) as where is the weakly bound two-body binding energy since for the attractive potential in 2D there is always a bound state (unlike the 3D case[52]). is the bandwidth which proportional to the absolute value of kinetic energy of the impurity (non-locality). For the case of flat impurity band, the reduced to the one in Refs.[21, 53, 52]. It is important to note that, for the above expression of , it is indeed the renormalized one but not the bare one, since it is dependent on the selection of the ultraviolet cutoff , otherwise it has when it is independent of the momentum (, i.e., the zero-range case). That also consistent with the obtained above.
We set the area for simplicity. Then the ground state matrix element is
[TABLE]
The last three terms take another electron momentum and hole momentum ( and ) in consideration, where the coefficients of the Chevy wave function satisfy
[TABLE]
Similar to the expression given above, we can approximately have, for example, . Here we regard scattering momentum as a constant. Thus we have
[TABLE]
For -independent coupling , the term can be omitted. By approximating , i.e., assuming the coupling parameters are local (which is valid in weak coupling limit with ), for normalization condition (at ground state with minimal energy), we obtain the Schrödinger equations
[TABLE]
As the time-dependence is evidented by the analytical approximation of the imaginary frequency, we have for noninteracting initial state with and fully interacting final state . Here the impurity (as well as the majority particles) in noninteracting state has momentum , while in the fully interacting ground state, the fraction of particle with nonzero momentum is related to the density of states[54]. We can also obtain that
[TABLE]
The nonzero quasiparticle weight (residue) (even at zero-momentum) guarantees the existence of the quasiparticle picture, which is broken when the impurity mass is infinite (with vanishing kinetic energy) and with the effect of Anderson orthogonality catastrophe.
8.2 B: Possible self-localization and the short-range potential in semi-Dirac system
As mentioned in the Sec.6, the strong Coulomb interaction and the electron-phonon coupling can give rise the self-localization of the polaron and narrow the bandwidth. Such phenomenon usual occurs in the presence of strong interspecies interaction (with near the critical value). For the case of strong self-localization, the Anderson localization and the RKKY interaction (for magnetic impurity[55]) may emerge. For example, for an impurity particle with infinite mass, the Anderson model can also be used to probe the three- or four-body problem[44, 56], in addition to the Efimov effect, which is widely used to dealing with the short-range resonant interaction between the heavy impurity and light (noninteracting) majority particles to forms the multibody bound state[64]. However, when the interactions between two small-size polarons are taken into account as in the magnetite[58] at finite temperature, the polaron is more delocalized even in the presence of electron-phonon coupling. Recently, the polaron formed in the surface state of a topological material has also been discussed[59, 14, 60, 61]. The polaron in the surface state of topological insulator or the topological crystalline insulator may have stronger delocalization against the disorders due to the protection from the average symmetries[62], which will be discussed detailly in another place.
We discuss the isotropic potential with contact interaction (zero-range) in the main text with the ultraviolet divergence regularization, for simpler analysis, but indeed the problem can also be solved beyond the approximation of contact interaction. For short-range anisotropic impurity, we introduce the quantum number to represent a distortion, the potential reads (by carrying the Wigner rotation), when the distortion vanishes (), the interaction potential becomes . Here denotes the Legendre polynomials. In momenstum representation, the potential reads
[TABLE]
where the Rayleigh equation is used,
[TABLE]
Here but only the part parallel to needed to be taken into account in the plane-wave expansion. Then we have
[TABLE]
8.3 C. Possible Experimental realization
As we mentioned above, the resonantly bound multibody states can be investigated by consider the Efimov correlations, for a configuration with several impurities (like the trimer or even the tetramer[63] bound states) short-range resonantly interact with the identical (noninteracting) bath particles (usually the bosons) in a quantum condensed phase. For example, two heavy electrons interact with the excited phonons through the -wave interaction, which can be realized also in the semi-Dirac system described in this article, in addition to the Bose gas. Here the impurity-boson scattering length is very large (compared to the effective range), and the boson-boson scattering length is also much shorter than the boson-impurity scattering length. As it is well known, the Efimov trimer requires the university limit . Apart from the BEC which requires the light enough bosons and low temperature, the condensed phase like the superconductivity or the supercurrent (e.g., in a Josephson junction setup), also provide us opportunities to study, e.g., the Fulde-Ferrell-Larkin-Ovchinikov (FFLO) pairing mechanism, expecially for a spin-imbalanced system as also revealed in the mesoscopic Josephson junction[65, 57]. The creation of exciton polaritons is reported[66, 22] in the experiments base on the semiconductor microcavity where the photons are confined within a cavity consist of the non-magnetic dielectric material, and strongly coupled to excitations. Then the cavity spectroscopy can used to probes the formation of polaron or polariton, just like the radiofrequency (rf) spectroscopy (of the impurity) for a fermi gas, or the Bragg spectroscopy for a BEC[67], which can be applied to the semi-Dirac system, like the VOTiO2 heterostructure, SnPSe3[69] or the organic conductor[68], as its low-energy (the region we focus on) characteristics lies somewhere between the gapped semiconductors and the Dirac semimetal[73], and it behaves more like the semiconductor when the gap is possitive (). Bse on the cavity spectroscopy, ont only the cavity resonance can be probed, the disperion of the semi-Dirac system (i.e., the real part of susceptibility) can also be obtained, which is similar to the technique of angle-resolved photoemission spectroscopy (ARPES). The obtained dispersion certainly should be continuous although the existence of the Fermion polaron, unlike the atomic system which with discrete levels. More importantly, since we consider the weak coupling regime in this paper, the quasiparticle weight (or spectral weigth) should be very large (closes one), which can be proved by the large overlap between the upper and lower levels (resonances). That’s due to the attractive Fermi polaron which prevents the electron-hole pair excitation from across the Fermi surface[22]. While when the two-body bound state formed (for the scattering length larger than a critical value), the spectral weigth vanishes and the metastability results in weak polaron peaks, as displayed during the polaron-to-molecule transition, which can be revealed in experiment by the vanishing peak of the rf spectrum for fermi gas. In such case, the problem is much easier to deal with simply by multiples the dimers, while for the multibody resonance where the immobile impurity (with infinite mass) induce the repulsions between the light majority particles[44].
As we discussed above, for the exciton-electron interaction-induced fermi polaron, the direct Coulomb interaction need not to be taken into account since the exciton is a neutral particle except when there exits the Coulomb-type impurity. This mechanism is also considered experimently in Ref.[22] base on a MoSe2 heterostructure upon the hexagonal boron nitride (hBN) substrate, however, in fact, the bose polaron should also exists in such system due to the electron-phonon coupling which is nonnegligible since the hBN is a polar substrate with large surface-optical phonon mode energy (lattice vibrations) as experimently measured[70, 71]. Thus for semi-Dirac system, the bose polaron can be obtained by controlling the electron-phonon coupling (through tunning the strain and change the distance between two-dimensional semi-Dirac sample and the substrate). Such tunning way is evidented by the distance (from electron to phonon and from substrate to semi-Dirac sample)-dependent factors within the expression of the electron-phonon coupling Hamiltonian, which reads (consider the longitudinal branch only)
[TABLE]
where is the complex amplitude of the electron-phonon coupling, is the anihilation operator of phonon which obeys . A complete Hamiltonian can be obtained by adding the above term into the Eq.(23). The interaction between electron from the semi-dirac material surface and the longitudinal optical phonons from the surface of polar substrate can be explored by the variational method where the ground state energy is obtained by minimizing the system expectation value, which should also be matched with the diagrammatic Monte Carlo method. According to the Lee-Low-Pines (LLP) unitary transformations[72], the ground state energy can be solved through a routine process:
[TABLE]
where is the variational function and is the eigenvalue of the transformed Hamiltonian. The relation is used during this process. That leads to
[TABLE]
Then the ground state energy can be obtained by solving
[TABLE]
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