Schrödinger-like formalism of relativistic quantum theory
for spin-zero particles (*)
YOUNG-SEA HUANG
Department of Physics, Soochow University - Shih-Lin, Taipei, Taiwan (ricevuto il 16 Aprile 1996; approvato il 30 Ottobre 1996)
Summary. — This paper presents a Schrödinger-like formalism of relativistic quantum theory alternative to the Klein-Gordon theory for spin-0 particles. The Schrödinger-like wave equation thus obtained is form-invariant, though its form is not manifestly Lorentz-covariant in the conventional sense. The alternative formalism resolves the great difficulties of negative probability density and Zitterbewegung in the Klein-Gordon theory. Ehrenfest’s theorem is preserved in the alternative formalism.
PACS 03.65 – Quantum mechanics. PACS 03.70 – Theory of quantized fields.
In relativistic quantum theory, the Dirac equation is used to describe spin-(1O2) particles, while the Klein-Gordon equation is used to describe spin-0 particles [1, 2]. The first section presents a Schrödinger-like formalism of relativistic quantum theory for spin-0 particles. The second section demonstrates that the Schrödinger-like formalism provides a simple scheme for solving relativistic quantum problems in a manner almost identical to what the Schrödinger wave equation does in non-relativistic quantum theory. Comparisons between the Schrödinger-like formalism and the Klein-Gordon theory are also given.
1. – Schrödinger-like formalism of relativistic quantum theory
According to special relativity, the total energy E and momentum p of a free material particle are E 4gmc2and p 4gmv, where m is the rest mass, c is the speed of light, and g 4 (12v2/c2)21 /2. The relativistic energy-momentum relation is
E2 2 p2c2
4 m2c4. (1)
(*) The author of this paper has agreed to not receive the proofs for correction.
From this equation, one has
Heff4 p2 2 m , (2)
if one defines the effective Hamiltonian Heff as
Hefff
E2
2 m2c4
2 mc2 .
(3)
Here, the effective Hamiltonian Heff for a free particle is 1 2mu
2
, where u 4gv. To obtain the wave equation of motion, one makes the replacement of the physical quantities in eq. (2) by the operators
p K2iˇ˜ (4) and HeffK iˇ ¯ ¯t , (5)
and lets the resulting operator equation act on a wave function c(r , t). Consequently, the wave equation of motion is obtained as
iˇ ¯ ¯t c(r , t) 42 ˇ2 2 m˜ 2 c(r , t) . (6)
Here, the time-like parameter t is the so-called proper time in Einstein’s special relativity; the time-like parameter t is related to the coordinate time t by dt 4g dt. The Schrödinger-like wave equation (6) has the plane-wave solution c(r , t) 4
A exp [2(iOˇ)(Hefft Z p Q r) ]. As an immediate consequence of the linear and homo-geneous properties of the Schrödinger-like wave equation, the wave packet c(r , t) 4 ( 2 pˇ)23 O 2
s
A(p) exp[
2(i O ˇ)
(
Heff(p) t Z p Q r)]
d3p is a solution of this wave equation. Now, generalize the above formulation by considering a relativistic particle moving in a field of potential V(r). According to special relativity, the energy-momentum relation is given as(E 2V)2 2 p2c2
4 m2c4. (7)
Rewriting eq. (7) and using the definition equation (3), one obtains
Heff4 p2 2 m 1 Veff, (8) where Vefff 2 EV 2V 2 2 mc2 . (9)
Here, the quantity Heff can be thought of as an energy inclusive of the Newton-like relativistic kinetic energy 1
2mu 2
replacing the physical quantities by their associated operators as given by eqs. (4) and (5), and then operating on a wave function c(r , t), eq. (8) results in the Schrödinger-like wave equation
iˇ ¯ ¯tc(r , t) 4
g
2 ˇ2 2 m ˜2 1 Veffh
c(r , t) . (10)As in the nonrelativistic quantum theory, one defines the probability density by
r 4c*(r, t) c(r, t) .
(11)
It is immediately evident from the Schrödinger-like wave equation (10) that the probability density satisfies the equation of continuity
¯
¯tr 1˜QJ40 , (12)
where J is the probability current density as given by
J 4 ˇ
2 mi(c * ˜c 2c˜c*) .
(13)
The probability density defined herein is positive-definite. The probability is conserved in accordance with the equation of continuity.
With the wave function c(r , t) being normalized to unity, the expectation value of a dynamical variable O(r , p) representing a physical quantity can be calculated by the expression aOb 4
s
c * (r , t) O× c(r, t) d3r, where O×4 O(r , 2iˇ˜) is the operator associated with the dynamical variable O. Consider the proper-time rate of change of the expectation value of the position vector, darb Odt. By using the Schrödinger-like wave equation (10) and its complex conjugate, one finds after a straightforward calculation that (14) darb dt 4
c * (r , t) r ¯c(r , t) ¯t d 3 r 1 ¯c * (r , t) ¯t rc(r , t) d 3 r 4 4 (iˇ)21k
c * rg
2ˇ 2 2 m ˜ 2 c 1Veffch
d3r 2g
2ˇ2 2 m ˜ 2 c * 1Veffc *h
rc d3rl
4 4 2iˇ m c * ˜c d3 r 4 apb m .Evidently, this result is the quantum counterpart of the equation p 4gmv4gmdrdt 4
mdr
dt in relativistic classical mechanics; thus, it supports the conjecture HeffK iˇ ¯ ¯t
as given in the beginning of the formulation. On the contrary, according to the Klein-Gordon theory, for a free spin-0 particle the Hamiltonian in the Schrödinger form of the Klein-Gordon equation is given by H×4 (s×
31 i s×2) p ×2 2 m1 mc 2 s × 3, where s×2
and s×
3 are the Pauli matrices [2-4]:
s ×14
u
0 1 1 0v
, s ×24u
0 i 2i 0v
, and s ×34u
1 0 0 21v
.Using the equation of motion in the Heisenberg picture, one has the “velocity operator” for a free spin-0 particle,
d r× dt 4 1 iˇ[r×, H×] 4 (s×31 i s × 2) p × m .
Since the eigenvalues of s×
31 i s×2 are zero, the eigenvalues of v× 4dr× /dt are zero. This peculiar result means that the measured mean value of the speed of a free spin-0
particle should be always equal to zero. Moreover, one has the “position
operator” [4] r×(t) 4 r×(0) 1 p × Ht 1 e2 iHt 2 1 2 iH
g
v×( 0 ) 2 p × Hh
.The last term on the right-hand side of this equation describes the so-called
Zitterbewegung—particles tremble rapidly even in the absence of external interaction [3-7]. The Klein-Gordon theory does not truly maintain Ehrenfest’s theorem, whereas the Schrödinger-like formalism presented herein does.
Consider, even more generally, a particle of charge e moving in external electro-magnetic field. According to special relativity, the relativistic energy-momentum relation is (E 2eF)22
g
P 2 e cAh
2 c24 m2c4. (15)Here, P 2 (eOc) A4pfgmv, as well as the scalar potential F(r, t) and the vector po-tential A(r , t) form a Lorentz covariant four-vector. This equation can be rewritten as
Heff4
g
P 2 e cAh
2 2 m 1 Veff, (16)where Vefff ( 2 EV 2V2) O2mc2, and V f eF . As in the above method, from eq. (16), one obtains the wave equation of motion
iˇ ¯ ¯t c(r , t) 4
C
`
`
`
D
g
2iˇ˜ 2 e cAh
2 2 m 1 VeffE
`
`
`
F
c(r , t) . (17)It should be noted that the form of the Schrödinger-like wave equation (17) is invariant among inertial frames via the Lorentz transformation on the energy-momentum space. From the Lorentz-invariant relativistic energy-energy-momentum relation eq. (15), and by the formulations as described above, one can construct the
like wave equation in each inertial frame. Consequently, the obtained Schrödinger-like wave equations in all inertial frames have the same form, though their form is not
manifestly Lorentz-covariant in the conventional sense.
2. – Applications of the Schrödinger-like formalism of relativistic quantum theory for spin-zero particles
2.1. The one-dimensional square step potential. – Consider a particle impinging on a potential step which has the form
V(x) 4./ ´ 0 , x E0 , V 4const , x D0 . (18) Case 1: V EE2mc2.
The kinetic energy of the particle in the region x D0 is larger than zero. From eq. (10), the time-independent wave equation of motion is
d2c(x) dx2 1 k 2 c(x) 40 , k 4
g
2 mHeff ˇ2h
1 /2 , for x E0 , (19a) and d2 c(x) dx2 1 k 8 2 c(x) 40 , k 84g
2 m(Heff2 Veff) ˇ2h
1 /2 , for x D0 . (19b)The general solution is
c(x) 4./ ´ A eikx 1 B e2ikx, x E0 , C eik 8 x, x D0 , (20)
where A, B, and C are constants. Since the particle is incident from the region x E0, the term e2ik 8 x is not included in the solution in the region x D0. By matching c(x) and dc(x) Odx across the step at x40, one obtains that A1B4C, and k(A2B) 4k 8 C. Consequently, one has
B A 4 k 2k 8 k 1k 8 , (21) and C A 4 2 k k 1k 8 . (22)
Now consider the probability current density J. Substituting the wave function eq. (20) into the probability current density J equation (13), one finds that
J 4./ ´
(ˇk Om)[NAN22 NBN2] , x E0 ,
(ˇk 8Om)NCN2, x D0 .
(23)
From eqs. (21) and (22), one has NBN2 NAN2 1 k 8 k NCN2 NAN2 4 1 . (24) Hence (ˇk Om)[NAN2
2NBN2] 4 (ˇk 8Om)NCN2; as it should be for the stationary state in this case, the probability current density is constant everywhere. Consequently, the reflection coefficient is R 4 NBN 2 NAN2 4 (k 2k 8)2 (k 1k 8)2 4
g
k
E22 m2c42k
(E 2V)22 m2c4h
2g
k
E2 2 m2c4 1k
(E 2V)2 2 m2c4h
2 , (25)and the transmission coefficient is
T 4 k 8 k NCN2 NAN2 4 4 kk 8 (k 1k 8)2 4 4
k
(E2 2 m2c4 )[ (E 2V)2 2 m2c4]g
k
E2 2 m2c4 1k
(E 2V)2 2 m2c4h
2 . (26)From eqs. (24), (25), and (26), one obtains, as expected, the conservation of probability flux, R 1T41.
Case 2: E 2mc2
E V E E 1 mc2.
The kinetic energy of the particle in the region x D0 is less than zero, but larger than 22mc2. Then, the equation of motion is
d2 c(x) dx2 1 k 2 c(x) 40 , k 4
g
2 mHeff ˇ2h
1 O2 , for x E0 , (27a) and d2 c(x) dx2 2 k 2 c(x) 40 , k 4g
2 m(Veff2 Heff) ˇ2h
1 O2 , for x D0 . (27b)The general solution is
c(x) 4./ ´ A eikx 1 B e2ikx, x E0 , D e2kx, x D0 , (28)
where A, B and D are constants. The term ekx is not included in the solution in the region x D0, because this term diverges in the limit xK1Q. By applying the boundary conditions that c(x) and dc(x) Odx are continuous at x40, one obtains that
A 1B4D, and ik(A2B) 42kD. Then, one has that BOA4 (1 2ikOk)O (1 1ikOk) 4 eia, and D OA42O (11ikOk), where a42 tg21(2kOk). Consequently, the reflection co-efficient is R4NBN2
Case 3: V DE1mc2.
In this case, the kinetic energy of the particle in the region x D0 is less than 22 mc2. Since Heff2 VeffD 0 for this case, the equation of motion is given, again, by eq. (19) in case 1. Consequently, the reflection coefficient R and the transmission coefficient T are given, respectively, by eq. (25) and eq. (26) in case 1. Thus, one has 0 G
R G1, 0 GTG1, and R1T41.
These predictions are the same as the predictions of the Klein-Gordon theory,
provided that in case 3 the sign of the momentum p in the equation
p2c2
4 (E 2 V)22 m2c4 is chosen to be positive [4, 8-11]. But, if p is chosen to be negative, then the Klein-Gordon theory predicts that the reflection coefficient R D1
and the transmission coefficient T E0 in the case 3—the so-called Klein
paradox [12, 13]. The paradoxical predictions in the regime of strong fields have never been tested experimentally [14, 15].
2.2. The pionic atom. – Consider a pionic atom consisting of a nucleus of charge 1Ze and a pion of mass m and charge 2e interacting by means of the Coulomb potential, V(r) 42Ze2O 4 pe0r , where r is the distance between the nucleus and the pion. Then, the time-independent wave equation H×effc(r) 4
g
2ˇ2
2 m˜ 2
1 Veff
h
c(r) 4Heffc(r) in polar spherical coordinates is given as
(29)
y
2 ˇ 2 2 mg
d2 dr2 1 2 r d drh
1 L ×2 2 mr2 2 E mc2g
Ze2 4 pe0h
1 r 2 2 1 2 mc2g
Ze2 4 pe0h
2 1 r2z
c(r , u , f) 4Heffc(r , u , f) ,where L× f2iˇ(r3˜). Since the operators H×eff, L×2 and L×z commute, and the
spherical harmonics Ylm(u , f) are simultaneous eigenfunctions of L×2 and L×z, solutions
of eq. (29) are expected as cE , l , m(r) 4RE , l(r) Ylm(u , f), where l 40, 1, 2, R, and m 42l, 2l11, R, l. By substituting cE , l , m(r) into eq. (29), the radial differential
equation follows as (30)
y
2 ˇ 2 2 mg
d2 dr2 1 2 r d drh
1 l(l 11) ˇ2 2 mr2 2 E mc2g
Ze2 4 pe0h
1 r 2 2 1 2 mc2g
Ze2 4 pe0h
2 1 r2z
R(r) 4HeffR(r) . Here, for simplicity, R(r) f RE , l(r). Let u(r) 4rR(r). In terms of the dimensionlessquantities a f e 2 4 pe0ˇc , l f Ze 2 4 pe0ˇc
g
2E2 2 mc2Heffh
1 O2 4 Zag
2E 2 2 mc2Heffh
1 O2 ,and
r f
g
28 mHeffˇ2
h
1 O2
r ,
eq. (30) then becomes
y
d2 dr2 2 1 4 1 l r 2 b(b 11) r2z
u(r) 40 , (31) where b(b 11) 4l(l11)2 (Za)2. By using u(r) 4e2r O 2rb 11f (r), one has the
differential equation for f (r)
y
r d 2 dr2 1 ( 2 b 1 2 2 r) d dr 1 (l 2 b 2 1 )z
f (r) 40 . (32)This equation has the generalized Laguerre polynomial L2 b 11
l 2b21 as its solution,
provided that n 8fl2b21 is a positive integer or zero [16]. Thus, the solutions of eq. (31) are
u(r) Ae2r O 2
rb 11Ll 2b212 b 11 (r) . (33)
By defining the principal quantum number as nfn 81l11, then one has l4n1b2l. Consequently, the normalized solutions of eq. (30) are
Rnl(r) 4
y
Z3 a03 4 l4g
1 1 (Za)2 l2h
23 O 2 G(l 2b) G(l 1b11)z
1 O2 e2r O 2rbL2 b 11 l 2b21(r) , (34)where a04 4 pe0ˇ2O me2, n 41, 2, 3, R, and l40, 1, 2, R, (n21). From eq. (3) and the definition of l , the bound-state energy eigenvalues are obtained as
(35) Enl4 mc2
C
`
D
1 1 (Za) 2g
n 2l212 1o
g
l 112h
22 (Za)2h
2E
`
F
21 O 2 4 4 mc2C
`
D
1 2 (Za) 2 2 n2 2 (Za)4 2 n4u
n l 112 2 3 4v
1 RE
`
F
.These bound-state energy eigenvalues are the same as those predicted by the Klein-Gordon theory [2]. Furthermore, Ncnlm(r , u , f) N2d3r 4NRnl(r) N2NYlm(u , f) N2d3r
represents the probability of finding the pion in a volume element d3r . On the contrary,
the probability density as defined in the Klein-Gordon theory is not
positive-definite [1, 2]; thus, it cannot represent the pionic probability distribution. The negative probability density problem casts a serious doubt on the adequacy of the Klein-Gordon equation as the wave equation for spin-0 particles, within the scope of the single-particle interpretation [17].
The two examples above show that the alternative formalism provides the familiar technique of nonrelativistic quantum mechanics for solving relativistic quantum problems.
* * *
The author gratefully thanks the valuable comments of Dr. C. M. L. LEONARDin the
preparation of this paper.
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