Electron states for gapped pseudospin-1 fermions in the field of charged impurity
E. V. Gorbar, V. P. Gusynin, D. O. Oriekhov

TL;DR
This paper investigates the electron bound states in a gapped pseudospin-1 fermion system within the $ ext{α-}{ ext{T}_3}$ lattice under Coulomb impurity potential, revealing how energy levels depend on impurity charge and lattice parameters.
Contribution
It provides analytical solutions for bound state energies in the $ ext{α-}{ ext{T}_3}$ lattice with Coulomb impurities, highlighting differences between the dice and graphene limits.
Findings
Bound states descend from continuum levels with increasing impurity charge.
The flat band persists in potential wells but not in Coulomb potentials.
Analytical solutions exist for discrete impurity charge values.
Abstract
The electron states of gapped pseudospin-1 fermions of the lattice in the Coulomb field of a charged impurity are studied. The free model has three dispersive bands with two energy gaps between them depending on the parameter which controls the coupling of atoms of honeycomb lattice with atoms in the center of each hexagon, thus, interpolating between graphene and the dice model . The middle band becomes flat one with zero energy in the dice model. The bound electron states are found in the two cases: the centrally symmetric potential well and a regularized Coulomb potential of the charged impurity. As the charge of impurity increases, bound state energy levels descend from the upper and central continua and dive at certain critical charges into the central and lower continuum, respectively. In the dice model, it…
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Electron states for gapped pseudospin-1 fermions in the field of charged impurity
E. V. Gorbar
Department of Physics, Taras Shevchenko National University of Kyiv, Kyiv, 03680, Ukraine
Bogolyubov Institute for Theoretical Physics, Kyiv, 03680, Ukraine
V. P. Gusynin
Bogolyubov Institute for Theoretical Physics, Kyiv, 03680, Ukraine
D. O. Oriekhov
Department of Physics, Taras Shevchenko National University of Kyiv, Kyiv, 03680, Ukraine
Abstract
The electron states of gapped pseudospin-1 fermions of the lattice in the Coulomb field of a charged impurity are studied. The free model has three dispersive bands with two energy gaps between them depending on the parameter which controls the coupling of atoms of honeycomb lattice with atoms in the center of each hexagon, thus, interpolating between graphene and the dice model . The middle band becomes flat one with zero energy in the dice model. The bound electron states are found in the two cases: the centrally symmetric potential well and a regularized Coulomb potential of the charged impurity. As the charge of impurity increases, bound state energy levels descend from the upper and central continua and dive at certain critical charges into the central and lower continuum, respectively. In the dice model, it is found that the flat band survives in the presence of a potential well, however, is absent in the case of the Coulomb potential. The analytical results are presented for the energy levels near continuum boundaries in the potential well. For the genuine Coulomb potential, we present the recursion relations that determine the coefficients of the series expansion of wave functions of bound states. It is shown that the condition for the termination of the series expansion gives two equations relating energy and charge values. Hence, analytical solutions can exist for a countably infinite set of values of impurity charge at fixed .
pacs:
81.05.ue, 73.22.Pr
I Introduction
Like the electrons in graphene, low-energy gapless pseudospin-1 fermions have the energy spectrum linear in momentum except the additional flat band with zero energy [Bercioux, ; Raoux, ]. Completely flat bands [Heikkila, ] can be realized in certain lattice models (for a recent review of artificial flat band systems, see Ref.[Flach, ]). The lattice is one of the well-known realizations of pseudospin-1 fermions in two dimensions (2D). It is a tight-binding model with atoms situated at both the vertices of a hexagonal lattice and the hexagons centers [Sutherland, ; Vidal, ]. Since there are three sites per unit cell, the electron states in the model are described by three-component fermions and the energy spectrum consists of three bands. Experimentally, the lattice has been realized in Josephson arrays [Serret, ] and its optical realization by means of laser beams was proposed in Ref.[Rizzi, ].
In the specific case when the two hopping amplitudes are equal, the lattice corresponds to the dice model. In linear order to momentum deviations from the and points, the low-energy Hamiltonian of the dice model describes massless pseudospin-1 fermions and is given by the scalar product of momentum and the spin-1 matrices. The two energy bands form a Dirac cone and the third band is completely flat and has zero energy [Bercioux, ; Raoux, ]. Several physical quantities have been studied in the lattice such as orbital susceptibility [Raoux, ], optical conductivity [Carbotte, ; Illes, ; Cserti, ], and magnetotransport [Nicol, ; Biswas, ; Xu, ; Islam, ].
Flat bands always attracted attention because quenching of the kinetic energy strongly enhances the role of electron-electron interactions and may lead to a realization of many very interesting strongly correlated states like, for example, the fractional quantum Hall states of 2D fermions. Sometime ago it was understood that flat bands could be realized in twisted bilayer graphene [Santos, ; Bistritzer, ] and recently, indeed, the correlated insulator behavior at half-filling [Cao, ] and unconventional superconductivity [Fatemi, ] was observed. The pairing problem in materials with three bands crossing was studied in Ref.[Lin, ]. A pressure induced superconductivity was reported in MoP [Chi, ] which hosts triply degenerate fermion states.
It is well known that the presence of boundaries and/or charged impurities removes the degeneracy of the electron states Landau levels. In a recent paper [dice-model-boundaries, ], we showed that, remarkably, the energy dispersion of the completely flat energy band of the dice model is not affected by the presence of boundaries except the trivial reduction of the degenerated electron states due to the finite spatial size of the system. It was shown also that the flat band for dice lattice remains unaltered in the presence of circularly polarized radiation [Dey2018, ]. The question whether the electron states of the flat band remain degenerate in the presence of charged impurities provides a part of the motivation for the present study.
In order to gain an insight into the general response of three-component fermions to potential perturbations, we consider the electron states of the lattice in two cases, namely, the radially symmetric potential well and a regularized Coulomb potential, and determine how electron bound states evolve with the strength of potential splitting from and diving into the continuum energy bands.
The paper is organized as follows. The model with a gap term is described in Sec.II. The spectral equation for pseudospin-1 fermions in a potential well is derived in Sec.III. The bound electron states on the lattice in a potential well and the Coulomb field of a charged impurity are studied in Secs.IV and V, respectively. The obtained results are discussed and summarized in Sec.VI. Some particular bound states solutions in a potential well in the and dice models are given in Appendices A and B.
II Gapped model
The lattice has a unit elementary cell with three different lattice sites whose two sites (A,C) like in graphene form a honeycomb lattice with hopping amplitude and additional B sites at the center of each hexagon are connected to the C sites with hopping amplitude (see Fig.1). The two hopping parameters and are not equal in general.
In this section, we will consider the low-energy free Hamiltonian of the gapped model, determine the Chern number of its three bands, calculate the corresponding density of states, and write down the system of equations for eigenspinors of the model in a centrally symmetric potential.
II.1 Free Hamiltonian
We begin with the low-energy kinetic Hamiltonian of the model [Raoux, ] with an additional gap term (we set )
[TABLE]
where and the valley index . The two valley Hamiltonian, , is time-reversal invariant since under time-reversal transformation . In what follows we consider only one valley Hamiltonian with for certainty, which breaks both the time reversal and particle-hole symmetries (the results for the other valley can be readily obtained in a similar way). The one valley Hamiltonian can be realized, for example, in the staggered-flux kagome lattice [Ohgushi, ; Green2010, ]. The spectrum of the Hamiltonian can be found from the third order equation
[TABLE]
Since the coefficient near term is zero, three roots satisfy . In the particular case of the dice model , it is easy to determine the dispersion of energy bands [Green2010, ; Gao, ]. The energy spectrum of the model is also easy to find in the gapless case whose spectrum does not depend on and the zero energy flat band touches two linearly dispersing bands at the point . In the general case, the energy dispersion can be found by using the Cardano formulas
[TABLE]
At large values of the middle band solution tends to . The other two bands are linear at large momentum . For small momenta, , the bands behave as
[TABLE]
Thus, for , there are two spectral gaps and and, for , the spectral gaps are and . For , the middle band is also dispersive: it has a hole-like dispersion for and a electron-like for angles . One can switch between two possibilities by changing hopping parameters in the Hamiltonian. The band structure for several values of the angle is shown in Fig.2. For (dice model), the middle band becomes dispersionless and completely flat. The spectrum in this case is particle-hole symmetric with the isolated flat band separated from two dispersive bands above and below by the gap . It is interesting that for another type of a gap term, , the flat band with the energy exists for arbitrary and touches either the upper () or lower () dispersive energy band [Raoux2015, ] (see panel (d) in Fig.2).
The normalized spinor can be written in the form (up to overall phase)
[TABLE]
For the dice model (), it reduces to the expression in Appendix of Ref.[Green2010, ], while for and arbitrary it reduces to the spinor in Ref.[Raoux, ] (see, also, Refs.[Dey2018, ; Iurov, ]).
II.2 Berry phase and curvature
The Berry phase is defined as a linear integral of the Berry connection
[TABLE]
where the Berry connection is given by the expression , and the integral goes over a close trajectory around the K point with constant band energy . The Berry phase is a gauge invariant quantity and its value is unique up to with integer. The Chern number of the band is defined as an integral of the Berry curvature over the Brillouin zone
[TABLE]
where . The Chern number is well defined when bands are separated by gaps. Then the Chern number is topological and can only change when a band touching happens. In our low-energy theory the integral in Eq.(16) can be written as an integral at an infinitely distant circumference
[TABLE]
where the angular component of the connection is calculated as
[TABLE]
The middle component of spinor (14) is real, however, it vanishes for at where . Therefore, its phase cannot be fixed at this point. For definiteness, let us consider the upper band (the analysis in the case of the lower band is quite similar). Since as , the upper component of the spinor (14) for does not vanish at . Obviously, we can make it real by multiplying the spinor (14) by where . [If , then the third component of the spinor does not vanish at and can be made real multiplying the spinor by . The subsequent analysis is similar to the case .] We obtain the following spinor:
[TABLE]
Then we find for arbitrary ,
[TABLE]
Combining the results for all three bands and calculating the limit , we find the Berry phases for the point ()
[TABLE]
which are in agreement with Ref.[Raoux, ] for in the gapless dice model (we assume ) except the overall sign minus (due to the definition of the connection with opposite sign). The Chern numbers are
[TABLE]
For the gapped dice model (), the Chern numbers coincide with those in Ref. [Green2010, ]. Note that . The Berry phases for the point () have opposite signs. As it was noticed in Ref.[Raoux, ] the Berry phases are topological but not quantized. Therefore, the corresponding Chern numbers calculated in an effective low energy theory are non-integer in general. The situation is similar to the calculation of the Chern number at the Dirac point in 2D, whose Chern number is half-integer. As discussed in Ref.[Volovik, ], this happens because the momentum space is not compact and the unit vector which characterizes the mapping from the momentum space to the Hamiltonian does not tend to the same value at infinity, but instead forms the 2D hedgehog. Therefore, it is better and more appropriate to characterize the considered low-energy theory through fluxes of the Berry curvature rather than the Chern number.
The Chern numbers can be calculated also by using the formula for the Berry curvature written as a sum over the eigenstates [XiaoRMP2010, ],
[TABLE]
This formula is manifestly gauge independent and has the advantage that no differentiation of the spinor functions is involved, therefore it can be evaluated for any fixed gauge. Hence it is no longer necessary to pick spinors to be smooth and single valued. Also this formula suggests that the Berry curvature could be divergent when there is a band touching as it contains in the denominator. The results of numerical calculations of the Chern numbers are shown in Fig.3 and are in agreement with the analytical formulas (25) for . The angles should be considered separately since in this case hoppings either from atoms A or atoms B vanish and we deal with graphene-like model for which we find .
We note that the Chern numbers are, of course, integer in a microscopic theory where the Brillouin zone has the form of a torus (see, for example, Ref.[Ohgushi, ] for a similar model.)
II.3 Density of states
By definition, the two-dimensional density of states (DOS) is given by
[TABLE]
In the particular case of the dice model, we can calculate the DOS analytically. The energy dispersion is given by and the density of states equals
[TABLE]
is the volume in momentum space. For other values of , the DOS cannot be found analytically. The results of numerical computations are shown in Fig.4 for the three values of .
II.4 Hamiltonian with centrally symmetric potential
The low-energy Hamiltonian of the gapped lattice model [Raoux, ] for pseudospin-1 fermions in a centrally symmetric potential reads in the polar coordinate system
[TABLE]
The total angular momentum operator is (the matrix is the matrix near in Eq.(7)). We seek the spinor as an eigenvector of with quantum number in the form
[TABLE]
and obtain the system of equations for components
[TABLE]
Combining Eqs.(34) and (36), it is easy to find that the system above gives the linear relation between three components ()
[TABLE]
which allows one to reduce system (34)-(36) to a second order differential equation for one component (see, e.g., Eq.(38) below found in the case of a potential well). We will analyze the solutions of the above system of equations in the simplest setting of a potential well, as well as the Coulomb centre.
III Potential well: spectral equation
In this section we consider the case of the potential well with the potential , . Since the potential does not depend on for and , we can obtain the following second-order equation for :
[TABLE]
We are interested in bound states solutions. We search them in the form
[TABLE]
where we use the notation
[TABLE]
By using Eqs.(39) and (34), we find the component
[TABLE]
In this function we have , which is singular at origin and can not meet normalization condition. Therefore, we set . Similarly, for the component, we get
[TABLE]
where we used the formulas
[TABLE]
[TABLE]
III.1 Matching conditions and spectral equation
Integrating the system of equations (34)-(36) for from up to and then taking the limit , we find that the 1st and 3rd equations imply that the -component is continuous at , i.e.,
[TABLE]
The 2nd equation of the system gives, obviously, the second matching condition
[TABLE]
Notice that there are only two matching conditions that is consistent with the fact that the system under consideration of three first-order differential equations for the three components reduces to the second-order differential equation for one component (38).
By using Eqs.(39), (41), and (42), we obtain that the matching conditions (49) and (50) lead to the following spectral equation for bound states:
[TABLE]
The centrifugal barrier grows with , therefore, we will consider in our analytic results only the electron bound states with and angular momenta. For , the above spectral equation takes the form
[TABLE]
In the case , Eq.(51) becomes
[TABLE]
IV Potential well: solutions for
In this section, we will determine bound state solutions for pseudospin-1 fermions in the model in a potential well for . Solutions for and for in the dice model can be found in a similar way and the details of the corresponding analysis are given in Appendices A and B. Since the states with total angular momenta and are the lowest energy states, only these states will be analyzed explicitly.
IV.1 Solutions descending from the upper continuum
Since near the upper continuum, we have
[TABLE]
and we can use the asymptotes of the MacDonald functions
[TABLE]
on the right-hand side of Eq.(51). For the state , Eq.(52) gives
[TABLE]
Clearly, this equation does not have solution at small potential strength, , since the left hand side of the equation is positive while the right hand side is negative. A nontrivial solution appears when exceeds some critical value which is determined by the first zero of the Bessel function . This gives the equation for the critical potential . For taking into account that , Eq.(56) simplifies to
[TABLE]
where
[TABLE]
The solution of this equation is given
[TABLE]
where is a non principal branch of the Lambert function which is real for [Corless, ]. Since
[TABLE]
we find
[TABLE]
For the state , Eq.(51) takes the following form near the upper continuum:
[TABLE]
This equation has the solution at any small
[TABLE]
For , the above expression is similar to that in graphene (see Eq.(2.19) in Ref.[Gamayun2011, ]). While the spectral gap in graphene is between and , the spectral gap here is between [math] and . Therefore, in order obtain the same formula as in graphene one should subtract from and then replace .
IV.2 Other analytical solutions
Let us consider solutions diving into the central continuum. For the state and , the critical potential is defined by the equation
[TABLE]
with the energy dispersion for given by
[TABLE]
For the state, the critical potential is determined by the transcendental equation
[TABLE]
We can find the energy of bound states for near critical potentials expanding Eq.(53) to the linear order in and . As a result, we obtain the Lambert-type equation, which has the solution
[TABLE]
Here is the short-hand notation for the derivative of the left-hand side of Eq.(53) with respect to at .
The spectral equation (52) for the state splitting from the middle band takes the form
[TABLE]
For , while the left-hand side is always positive, the right-hand side is negative, therefore, there are no solutions in this case. When from the above, the left-hand side oscillates in the range , while the right-hand side remains constant at a given . Therefore, there are many solutions when reflecting an essential singularity in the Bessel functions at large value of their argument. The same situation takes place for each , therefore, there are always the corresponding solutions for .
Finally, let us consider states diving into the lower continuum. They exist for in the interval . The critical value for the state is defined by the equation
[TABLE]
The critical value when the states dives into the lower continuum is defined by the equation , i.e., the first zero of the Bessel function : . It is not difficult to check that for diving into the lower continuum of the state is less than for the state . According to Eq.(45), , and . The corresponding solution near behaves as with .
IV.3 Numerical solutions: general picture
In order to get a general picture of the evolution of bound state solutions and compare the corresponding results with those obtained analytically above, we numerically solve Eq.(51) and plot as a function of for the first several solutions with in Fig.5 at the three representative values .
The behavior of the spectra near boundaries of the upper, middle, and lower bands agrees very well with our analytical results presented above. According to panels (a) and (c), the general picture of the evolution of bound states with is the following. Starting from some non-zero critical value of , bound state solutions split from the upper continuum , traverse the upper spectral gap, dive into the middle band, and then reappear near the lower boundary of the middle band. Obviously, the states diving to and splitting from the middle band can be smoothly connected by drawing the corresponding imaginary lines. This conclusion is especially evident from panel (b) where the evolution of bound state solutions is shown in the dice model whose middle band is completely flat. Finally, as increases further, these states dive into the lower continuum .
According to panels (a)-(c), there are also bound states which split from the middle band at any small . As the potential strength increases, these states dive into the lower continuum. A red strip observed on panels (a) and (c) represents, in fact, a visual merging of distinct bound state solutions. A zoom-in of panel (c) for small values of plotted in panel (d) shows this explicitly. The two highest blue and red curves on this zoom-in demonstrate the level crossing of solutions with and . Since is different for these states, such a crossing is not forbidden by the von Neumann–Wigner theorem [Neumann-Wigner, ].
V Coulomb center
In this section, we will find bound state solutions for pseudospin-1 fermions in the Coulomb field of a charged impurity. We begin with the system of equations (34)-(36) setting there .
We showed in Sec.II that the system of the first order differential equations (34) - (36) leads to relation (37) among the spinor components which does not contain derivatives. Such a relation is important because it allows us to obtain a second order differential equation for one component, e.g., rather than a third order differential equation as one would naively expect. Unfortunately, the corresponding equation, unlike Eq.(38) in the case of a potential well, does not admit, in general, solutions in terms of the known special functions. Still analytic solutions can be found in some particular cases.
V.1 Some analytic solutions
In this subsection we determine analytic bound state solutions for pseudospin-1 fermions in the field of a charged impurity by using power series expansion and analyze analytically the presence of zero energy solutions in the dice model for which the system of (34)-(36) simplifies significantly.
V.1.1 Expansion in series
We can seek solutions for bound states of the system (34) - (36) by using the power series expansion for spinor components of the form
[TABLE]
Clearly, the behavior of the wave function at infinity is determined by and the expansion proceeds over with . Then, we get the system of recursion relations for the coefficients and which we write in the matrix form
[TABLE]
where and the matrices are
[TABLE]
Setting in Eq.(71) and taking into account that we find that a nontrivial solution for zero components exists if which determines the exponent and, thus, the behavior of solutions at small distances
[TABLE]
[compare with a similar solution in the dice model in [Sun, ]]. The second solution with the negative sign before the square root in the equation above leads to a divergent wave function at and should be rejected. However, when the expression under the root becomes negative for a charge exceeding some critical value , both exponents are admissible and the “fall-to-the-center” takes place for pseudospin-1 fermions. The situation is the same as for the three and two dimensional fermions described by the corresponding Dirac equations [fall-to-center, ]. As is well known, the fall-to-the-center is avoided if the singular potential is replaced by a regularized one (in the condensed matter setting the Coulomb potential is always naturally regularized at least by the lattice size). For subcritical charges, , the spectrum in the case of the non-regularized Coulomb potential could be determined if the series in Eq. (70) terminate at some .
To find possible terminations we note that the determinant of the matrix is zero in view of the definition of . Further, is nonzero for , where we used the definition of . Therefore, the system of equations (71) makes possible to determine in terms of . The condition that the series terminate at certain leads to the two following systems of equations:
[TABLE]
Clearly, there are six equations for the three variables . However, because and , there are, in fact, four independent equations for three variables. For such a system of linear equations to be consistent, it is necessary that its rank to be less than three. For example, for the termination , the minors of the third rank must vanish, and we obtain the three conditions for the existence of a nontrivial solution
[TABLE]
Only two of them are independent. For example, the second equation is a linear combination of the first and third equations. For the termination , we have and the following two systems of equations:
[TABLE]
Since solutions with and belong to the termination , we looks for solutions of the above matrix equations with . For terminations with , the system of equations (82) always gives two independent conditions to determine eigenenergies. One of them can be derived straightforwardly from the system (71) as a consequence of . Multiplying the first equation of the system by , the third equation by and adding them to the second equation, we find the relation between and valid at arbitrary
[TABLE]
Next, we set . Then we find from that
[TABLE]
Together with Eq.(V.1.1) at this gives a nontrivial solution for when the following condition is satisfied:
[TABLE]
One can check that for this equation coincides with the second equation in system (81) if and are substituted by their expressions from the first and third equations, respectively. We did not manage to find the second relation among in a convenient form at arbitrary . Unfortunately, their explicit expressions become very cumbersome with increasing . In any case, these two conditions give analytical solutions for a countably infinite set of values of charge at fixed angle . Thus, the considered system presents an example of the so-called quasiexactly solvable model. Some selected solutions for , , and fall on the blue curve shown in Fig.6.
For and , we deal with graphene-like system and the problem greatly simplifies since the recursive relations (71) contain in this case only two equations for two coefficients. For example, for , the matrices and take the form
[TABLE]
where now and . We find the spectrum
[TABLE]
Under the change the spectrum turns into that for a Coulomb center in graphene [graphene-Coulomb, ].
V.1.2 The absence of solutions with zero energy in the dice model
Perhaps one of the most interesting cases is the presence of zero energy solutions and the fate of the flat band in the dice model in the field of the Coulomb potential. Our analysis in Subsec.IV and Appendix B shows that the flat band survives in a potential well although there are electron bound states which split from the flat band even in the case of an arbitrary shallow potential well. In order to see whether the flat band survives in the Coulomb center, we consider the system of equations (34)-(36) which for and simplifies to
[TABLE]
where . By adding and subtracting the first and third equations, we obtain
[TABLE]
The latter equation makes possible to eliminate from the second equation in (V.1.2) and the first equation in (95). Then we find
[TABLE]
Determining from the first equation of the system above and substituting it in the second equation, we obtain the following second order differential equation for :
[TABLE]
whose general solution can be easily expressed in terms of the modified Bessel functions
[TABLE]
Since is an exponentially growing function at large , we should set to zero in order to have normalized solutions. Further, since at small , we should set unless is exactly equal to (the corresponding solutions will be analyzed in the next subsection). Since there are no solutions with zero energy, we conclude that the flat band in the dice model does not survive in the pure Coulomb potential like it happens in the case of Landau levels for the electrons in the Coulomb field. The zero-energy solutions do not exist also for a regularized Coulomb potential of the form . Indeed, though in this case we can match two solutions, and at the boundary (Eq.50), we cannot satisfy the boundary condition (49). The numerical studies in the next section confirm the absence of zero-energy solution for a regularized Coulomb potential. This result is different from that in the case of a potential well where, according to the analysis in Appendix B, the flat band survives in a potential well. Technically, the reason is that Eq.(117) is automatically satisfied outside the potential well. Therefore, the solution is arbitrary there and could be always matched to that in the potential well.
V.2 Numerical solutions
Since there are no analytical solutions for the spectrum in the case of arbitrary and , below we determine bound state solutions for pseudospin-1 fermions in a regularized Coulomb potential numerically. For this, we adopt the same approach as in Ref.[Oriekhov, ] and solve the following integral equation in momentum space:
[TABLE]
where is given by Eq.(7) and
[TABLE]
Here is the wave vector cut-off and in the regularized Coulomb potential includes the dielectric constant of substrate. The system for the components of the wave function has the form
[TABLE]
The integrals over the angle can be calculated analytically [Oriekhov, ],
[TABLE]
where is the Legendre function of the second kind. Rewriting the above system of equations in terms of kernels , we obtain
[TABLE]
Further, we replace the integrals in the above system of equations by regularized sums
[TABLE]
The analytical expressions for the last integral can be found in Ref.[Oriekhov, ]. We solved numerically the system of equations (V.2) for the states with different , the corresponding results for the states are presented in Fig.7.
As expected, the energy levels monotonously decrease as increases and then dive into the middle or lower continua. For the clarity of presentation, only few levels are plotted in the lower spectral gap. In particular, the dashed lines correspond to bound states which are the continuation of bound state levels from the upper spectral gap (this is especially clear from panel (b) in the case of the dice model). This picture is in agreement with results for the potential well in Sec.IV. We found also that if the cut-off is sufficiently large, then the electron bound state with crosses the state in the upper spectral gap as the charge of impurity increases. For intermediate values of a cut-off like in Fig.7, such a crossing maybe absent. On the other hand, no such a crossing is observed in the lower spectral gap between the central and lower continua.
VI Summary
We studied the electron states of pseudospin-1 fermions of the lattice with a gap term in the field of a charged impurity. We analyzed electron bound states in the two cases: a long-range Coulomb potential (both regularized and unregularized) and the short-range centrally symmetric potential well. In the later case, matching solutions inside and outside the potential well, the spectral equation for the electron bound states is found. The analytical results are presented for the energy levels near continuum boundaries. The analysis shows that a critical value of the strength of the potential is needed in order that bound states split from the upper continuum. For sufficiently large , such states dive into the central continuum. One of our principal findings is that electron bound states split from the central continuum at arbitrary small .
The same result applies to the dice model, which is a particular case of the model with . Its central band is a degenerate completely flat band. This band survives in a centrally symmetric potential well, although as the strength of the potential increases, more and more bound states with higher value of the total angular momentum split from the flat band. The main reason responsible for the survival of the flat band in a sharp potential well is the fact that the solution outside the potential well is an arbitrary function and, thus, can always be matched to the solution inside the potential well. Consistent with this, we found that in the Coulomb potential, where the region without the potential perturbation is absent, there are no solutions with zero energy. Consequently, the flat band does not survives in this case. The Coulomb potential is the long-range one, while the sharp potential well corresponds to the case of a potential with compact support. These two potentials are, in a certain sense, two opposite cases. Therefore, it would be interesting to study whether the flat band survives in the case of a short-range potential with noncompact support.
For the genuine Coulomb potential, by using a generalized expansion in a power series, we were able to obtain analytic solutions for a countable set of values of impurity charge at fixed . For a regularized Coulomb potential, we found electron bound states by solving numerically the integral equation in momentum space. The bound states solutions descend from the upper continuum and the central continuum ( for and for ). As the charge of impurity increases, these states dive into the central and lower continuum, respectively, at certain critical charges. We found that the state with the total angular momentum first splits from the upper continuum. The electron bound state with may cross the state in the upper spectral gap as the charge of impurity increases. On the other hand, no such a crossing is observed in the lower spectral gap between the central and lower continua.
It is well known that the atomic collapse in the one electron problem in the field of a charged impurity is a precursor of the supercritical instability and the quasiparticle gap generation in a many body system [Gamayun2010, ]. Therefore, a natural extension of the present study would be the investigation of the gap generation for pseudospin-1 fermions in the model.
VII Acknowledgments
We are grateful to Jean-Noel Fuchs for fruitful discussions on the topological properties of the considered model. The work of E.V.G. and V.P.G. is partially supported by the National Academy of Sciences of Ukraine (project 0116U003191) and by its Program of Fundamental Research of the Department of Physics and Astronomy (project No. 0117U000240). V.P.G. acknowledges the support of the RISE Project CoExAN GA644076.
Appendix A Solutions for in a potential well
Since solutions near the upper continuum and the lower continuum are the same as found in Sec.IV for , we do not repeat the corresponding analysis here.
A.1 Solutions diving into the middle gap
We look for solutions with . While the function remains finite for , the function behaves as
[TABLE]
For the state , the spectral equation (52) takes the form
[TABLE]
The critical potential is determined by the first root of the Bessel function , namely, . By using the identity , and near the first root of Eq.(111) and we find the behavior of the energy level near the critical potential strength ,
[TABLE]
The spectral equation (51) for the state becomes
[TABLE]
Since , the solution is defined by the root of the left-hand side of the above equation.
A.2 Solutions descending from the middle gap
For solutions descending from the central continuum from , it is convenient to set with .
For the state , the functions and become
[TABLE]
The spectral equation (52) takes the form
[TABLE]
The critical potential is lower than and is determined as the first root of the Bessel function .
The equation (51) for the state equals
[TABLE]
and determines the critical value of potential for which the electron bound state separates from the central continuum. Since , the state with is the lowest bound state.
Appendix B Solutions in dice model for
The dice model is realized at . The central continuum in the model reduces in the dice model to a completely flat degenerate band of zero energy . As discussed in the Introduction, we recently found [dice-model-boundaries, ] that the energy dispersion of the completely flat energy band of the dice model is not affected by the presence of boundaries except the trivial reduction of the degenerated electron states due to the finite spatial size of the system. This gives rise to the question whether the electron states of the flat band remain degenerate also in the presence of a potential perturbation. We study this question in this Appendix.
In the dice model with the potential well , Eq.(38) leads to the following equation for the component:
[TABLE]
The and components are defined through as follows:
[TABLE]
For , we find the solution regular at ,
[TABLE]
where .
Now we should find solution at . First of all, we see that Eq.(117) is identically satisfied for at . This means that is an arbitrary function in this region. [This can be seen directly also from system (V.1.2) setting , expressing from the first and third equations of the system and through , substituting them into the second equation, and checking that it is automatically satisfied.]
In the absence of a potential, Eq.(14) defines a solution at fixed momentum . Then the general solution in coordinate space for the middle band in the dice model is defined as the Fourier transform of momentum space solutions with arbitrary coefficient function
[TABLE]
Further, in order to match this solution with the solution inside the potential well (118) and (119), we should determine when the general solution (123) defines the state with the angular momentum . According to Eq.(33), the upper, middle, and lower components of such a state should depend on the angular variable as , , and , respectively. Let us check that the natural choice , where is an arbitrary function of , provides the necessary solution. Indeed, for the middle component, we have
[TABLE]
By making the change of variable , we obtain
[TABLE]
Here, in order to calculate the integral over , we took into account that this is the integral of a periodic function over period. Therefore, the presence of in the limits of integration is irrelevant. It is easy to check that the upper and lower components of the spinor also result in the correct dependence on .
Thus, we have the following general solutions with the total angular momentum in the regions and :
[TABLE]
According to Eqs.(49) and (50), the component and the sum of the and components of the solutions inside and outside the potential well should be matched at . Thus, we have
[TABLE]
Determining from Eq.(133) and substituting it into Eq.(134) results in one integral condition for . This integral condition can be easily satisfied and practically does not restrict . This means the flat band does survive in the presence of a potential well.
As to the bound states, the analytical formulas for the energy levels near the boundaries of upper and lower spectral gaps can be easily obtained similarly to the analysis in the case . The corresponding results are presented in Fig.5. They show that an arbitrary weak perturbation leads to splitting of bound state solutions with and from the flat band. Therefore, potential perturbations due to inevitable disorder will remove in real systems the absolute degeneracy of the flat band in the dice model. We would like to note that disordered flat bands on the kagome lattice was recently studied in [Bilitewski, ].
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