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Solutions of the Klein Gordon equation with generalized hyperbolic potential in D-dimensions

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Published 23 September 2019 © 2019 The Author(s). Published by IOP Publishing Ltd
, , Citation Uduakobong S Okorie et al 2019 J. Phys. Commun. 3 095015 DOI 10.1088/2399-6528/ab42c6

2399-6528/3/9/095015

Abstract

We solve the D- dimensional Klein–Gordon equation with a newly proposed generalized hyperbolic potential model, under the condition of equal scalar and vector potentials. The relativistic bound state energy equation has been obtained via the functional analysis method. We obtained the relativistic and non-relativistic ro-vibrational energy spectra for different diatomic molecules. The numerical results for these diatomic molecules tend to portray inter-dimensional degeneracy symmetry. Variations of the energy eigenvalues obtained with the potential parameters have been demonstrated graphically. Our studies will find relevant applications in the areas of chemical physics and high-energy physics.

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Introduction

Researchers over the years have continually sought for solutions of wave equations with potential energies both in the non-relativistic and relativistic quantum mechanical systems [1, 2]. These solutions will provide all the necessary information needed to explain the behavior of any physical system. In addition, the solutions of these wave equations are highly applicable in chemical physics and high-energy physics at higher spatial dimensions [3]. Klein–Gordon (KG) equation is a basic relativistic wave equation that is well known to describe the motion of spin zero particles [4]. Different investigations have been carried out to obtain the exact and approximate solutions of the KG equation with different potentials, via various methods including the asymptotic iteration method (AIM) [5], Nikiforov-Uvarov (NU) method [6], supersymmetric quantum mechanics (SUSYQM) [7], algebraic approach [8], exact and proper quantization rules [9], modified factorization method [10, 11] and others [1216].Many authors have studied the solutions of the D-dimensional Klein–Gordon equation with diatomic molecular potential energy models [1725]. Analytical solutions of the KG equation and Dirac equation have been obtained for the conventional form of the Rosen-Morse (RM) potential energy model [26, 27]. Chen and his collaborators [28] studied the relationship between the D-dimensional relativistic ro-vibrational energies with applications to the Lithium diatomic molecule. In addition, RM type scalar and vector potential energy model was employed to obtain the s-wave bound state energy spectra [29]. Villalba et al [30] considered the bound state solution of a one-dimensional Cusp potential model, confined in the KG equation. The bound state solution of the KG equation with mixed vector and scalar PT potential energy with a nonzero angular momentum parameter was investigated by Xu et al [31]. Badalov et al [32] used NU to study any l-state of the KG equation, with the help of a Pekeris-like approximation scheme. In similar development, Ikot et al [33] solved the KG equation with the Hylleraas potential model and obtained its exact solution. Also, Hassanabadi and his collaborators [20] studied a combined Eckart potential and modified Hylleraas potential energy in higher dimensional KG equations using supersymmetric quantum mechanics method. Jia et al [22] investigated the bound state solution of the KG equation with an improved version of the Manning-Rosen potential model. Ortakaya [34] solved the D-dimensional KG equation and obtained the bound state energy spectrum for three different diatomic molecules using pseudoharmonic oscillator potential model. Chen et al [28] employed the improved MR potential energy in D-spatial dimensions to obtain the relativistic bound state energy equation. Also, Ikot et al [35] analyzed the improved MR potential energy for arbitrary angular momentum parameter using an approximate method in D-dimensions. Xie et al [36] studied the bound state solutions of the KG equation with the Morse potential energy in D-spatial dimensions. Ikot and his co-authors [37] employed NU method to investigate the D-dimensional KG equation with an exponential type molecule potential model. Hyperbolic potential models have been used as the empirical mathematical models in describing various inter-atomic interactions for diatomic and polyatomic molecules [38]. Deformed hyperbolic functions have also been studied and its non-relativistic energy spectra obtained via different methods [3944].Most recently, Durmus [45] studied the Dirac equation with equal scalar and vector hyperbolic potential function using the AIM, with the help of Greene and Aldrich approximation scheme. The author also investigated the relativistic vibrational energy spectra for various electronic states of some alkali metal diatomic molecules.Motivated by the work of Durmus [45], we propose a generalized hyperbolic potential (GHP) of the form

Equation (1)

where ${V}_{1},\,{V}_{2},\,{V}_{3},\,{V}_{4}$ are potential parameters, and $\alpha $ is the range of the potential.

Using the functional analysis method, we investigate the approximate bound state solution of the KG equation with GHP in higher spatial dimensions. We also explore the properties of the D-dimensional relativistic and non-relativistic ro-vibrational energy spectra for the GHP analytically and numerically for some selected diatomic molecules.

Bound state solutions

The Klein–Gordon equation with a scalar potential $S\left(r\right)$ and a vector potential $V\left(r\right)$ in D-dimensions reads [46]

Equation (2)

where $D$ represents the spatial dimensionality and $D\geqslant 2,{{\rm{\nabla }}}_{D}^{2}$ represents the Laplace operator in D-dimensions, $\hslash $ is the reduced Planck constant, $c$ and $E$ are the speed of light and relativistic energy of the system, respectively. Also, the wave function can be given as ${\rm{\Psi }}\left(r,{{\rm{\Omega }}}_{D}\right)={r}^{-\displaystyle \frac{D-1}{2}}{u}_{vJ}\left(r\right){Y}_{Jm}\left({{\rm{\Omega }}}_{D}\right),$ where ${Y}_{Jm}\left({{\rm{\Omega }}}_{D}\right)$ is the generalized spherical harmonic function. Employing the eigenvalues of the generalized angular momentum operator ${L}_{\,D}^{2}\left({{\rm{\Omega }}}_{D}\right),$ where

Equation (3)

we write the radial part of the D-dimensional Klein–Gordon equation (2) as

Equation (4)

where $K=J+\tfrac{1}{2}\left(D-3\right),$ ${E}_{vJ}$ represents the relativistic ro-vibrational energy eigenvalues in D-dimensions, $v\,{\rm{and}}\,J$ represents the vibrational and rotational quantum numbers, respectively. For equal scalar and vector potentials, $S\left(r\right)=V\left(r\right),$ equation (4) becomes

Equation (5)

Rescaling the scalar potential $S\left(r\right)$ and vector potential $V\left(r\right)$ under the non-relativistic limit, we adopt the Alhaidari et al [47] scheme to write equation (4) as

Equation (6)

With the equal scalar and vector potential being taken as the generalized hyperbolic potential,$S\left(r\right)=V\left(r\right)={U}_{HGP}\left(r\right),$ we obtain the following second-order Schrodinger-like equation as,

Equation (7)

Due to the presence of the centrifugal term in equation (7), we employ the Greene-Aldrich approximation scheme [48]

Equation (8)

As noted in [45], the above approximation is seen to be valid only for short range potential with small potential range, $\alpha .$ This approximation tends to break down for large $\alpha .$

Substituting equation (8) and introducing coordinate transformation of the form $s={\tanh }^{2}\left(\alpha \,r\right),$ we get

Equation (9)

where

Equation (10)

Equation (11)

Equation (12)

Also, we propose the wave function as

Equation (13)

where

Equation (14)

Equation (15)

We find that equation (9) turns into a Gauss hypergeometric-type equation of the form

Equation (16)

where

Equation (17)

The solution of equation (16) can be expressed in terms of the hypergeometric function given below

Equation (18)

where

Equation (19)

Equation (20)

Equation (21)

To obtain the energy relation, we equate either equations (19) or (20) to a negative integer (say $-\,v$). Hence, we choose

Equation (22)

Substituting equations (10)–(12), (14), (15) and (17) into (22), we obtain the D-dimensional relativistic ro-vibrational energy spectra for the GHP in the form

Equation (23)

To obtain the nonrelativistic ro-vibrational energy spectra for the GHP, we employ the following mapping: ${E}_{vJ}+\mu {c}^{2}\to 2\mu {c}^{2}\,{\rm{and}}\,{E}_{vJ}-\mu {c}^{2}\to {E}_{vJ}.$With these mapping we obtain

Equation (24)

The normalization of the wave function can be determined as shown in appendix appendix.

Results and discussion

We consider different diatomic molecules ($HCl,NiC,CO,{I}_{2}$) with spectroscopic parameters as shown in table 1. These parameters were adopted from [49] and applied to equation (24) to compute the numerical values of the non-relativistic ro-vibrational energies for arbitrary quantum numbers in different dimensions, as shown in tables 25. We observe from the tables presented that the non-relativistic ro-vibrational energies for the selected diatomic molecules decrease as the quantum numbers ($v,J$) increase. Also, for any quantum state, there is a decrease in ro-vibrational energies as the dimension increases. This trend is consistent with the relation of energy eigenvalues and quantum numbers, as observed in [49] for the selected diatomic molecules. In addition, we observe that there exist an inter-dimensional degeneracy symmetry for the selected diatomic molecules (${E}_{v,J}^{D}={E}_{v,J-1}^{D+2}$). This implies that the nonrelativisticro-vibrational energy spectra for the GHP is invariant under a transformation of an increase in the D-dimension by two ($D\to D+2$) and a decrease in the rotational quantum number by one ($J\to J-1$).

Table 1. Spectroscopic Parameters for the selected diatomic molecules.

Molecule $\alpha \left(\mathring{\rm{A}} \right)$ $\mu \left(amu\right)$
$HCl$ $1.8677$ $0.9801045$
$NiC$ $2.25297$ $9.974265$
$CO$ $2.2994$ $6.8606719$
${I}_{2}$ $1.8643$ $63.45223502$

Table 2. Energy spectra ${E}_{vj}({\rm{in}}\,{\rm{eV}})$ of $HCl$ for arbitrary $v\,{\rm{and}}\,j$ quantum numbers at different dimensions with $\hslash c=1973.29\,{\rm{eV}}\mathring{\rm{A}} ,{{\rm{V}}}_{{\rm{1}}}=2,{{\rm{V}}}_{{\rm{2}}}=2,{{\rm{V}}}_{{\rm{3}}}=4\,{\rm{and}}\,{{\rm{V}}}_{{\rm{4}}}=-4.$

$v$ $j$ ${E}_{vj}^{D=3}$ ${E}_{vj}^{D=4}$ ${E}_{vj}^{D=5}$ ${E}_{vj}^{D=6}$
$0$ $0$ 3.992 561 0163.992 363 3443.992 028 3413.991 547 708
$1$ $0$ 3.933 049 1463.932 458 7223.931 469 5393.930 073 901
  $1$ 3.931 469 5393.930 073 9013.928 261 0903.926 017 406
$2$ $0$ 3.814 025 4053.813 042 2303.811 398 8653.809 088 223
  $1$ 3.811 398 8653.809 088 2233.806 100 4283.802 422 859
  $2$ 3.806 100 4283.802 422 8593.798 040 2103.792 934 558
$3$ $0$ 3.635 489 7933.634 113 8673.631 816 3223.628 590 675
  $1$ 3.631 816 3223.628 590 6753.624 427 8963.619 316 441
  $2$ 3.624 427 8963.619 316 4413.613 242 3143.606 189 122
  $3$ 3.613 242 3143.606 189 1223.598 138 1503.589 068 449
$4$ $0$ 3.397 442 3113.395 673 6333.392 721 9083.388 581 256
  $1$ 3.392 721 9083.388 581 2563.383 243 4943.376 698 152
  $2$ 3.383 243 4943.376 698 1523.368 932 5483.359 931 814
  $3$ 3.368 932 5483.359 931 8143.349 678 9893.338 155 080
  $4$ 3.349 678 9893.338 155 0803.325 339 1413.311 208 372

Table 3. Energy spectra ${E}_{vj}({\rm{in}}\,{\rm{eV}})$ of $NiC$ for arbitrary $v\,{\rm{and}}\,j$ quantum numbers at different dimensions with $\hslash c=1973.29\,{\rm{eV}}\mathring{\rm{A}} ,\,{{\rm{V}}}_{{\rm{1}}}=2,\,{{\rm{V}}}_{{\rm{2}}}=2,\,{{\rm{V}}}_{{\rm{3}}}=4\,{\rm{and}}\,{{\rm{V}}}_{{\rm{4}}}=-4.$

$v$ $j$ ${E}_{vj}^{D=3}$ ${E}_{vj}^{D=4}$ ${E}_{vj}^{D=5}$ ${E}_{vj}^{D=6}$
$0$ $0$ 3.998 936 3433.998 925 6953.998 907 8333.998 882 582
$1$ $0$ 3.990 427 0853.990 395 1963.990 341 9343.990 267 130
  $1$ 3.990 341 9343.990 267 1303.990 170 5453.990 051 877
$2$ $0$ 3.973 408 5713.973 355 4393.973 266 7773.973 142 419
  $1$ 3.973 266 7773.973 142 4193.972 982 1353.972 785 627
  $2$ 3.972 982 1353.972 785 6273.972 552 5363.972 282 432
$3$ $0$ 3.947 880 7993.947 806 4253.947 682 3633.947 508 452
  $1$ 3.947 682 3633.947 508 4523.947 284 4663.947 010 120
  $2$ 3.947 284 4663.947 010 1203.946 685 0623.946 308 875
  $3$ 3.946 685 0623.946 308 8753.945 881 0843.945 401 147
$4$ $0$ 3.913 843 7693.913 748 1533.913 588 6913.913 365 226
  $1$ 3.913 588 6913.913 365 2263.913 077 5413.912 725 356
  $2$ 3.913 077 5413.912 725 3563.912 308 3313.911 826 061
  $3$ 3.912 308 3313.911 826 0613.911 278 0863.910 663 877
  $4$ 3.911 278 0863.910 663 8773.909 982 8513.909 234 363

Table 4. Energy spectra ${E}_{vj}({\rm{in}}\,{\rm{eV}})$ of $CO$ for arbitrary $v\,{\rm{and}}\,j$ quantum numbers at different dimensions with $\hslash c=1973.29\,{\rm{eV}}\mathring{\rm{A}} ,{{\rm{V}}}_{{\rm{1}}}=2,\,{{\rm{V}}}_{{\rm{2}}}=2,\,{{\rm{V}}}_{{\rm{3}}}=4\,{\rm{and}}\,{{\rm{V}}}_{{\rm{4}}}=-4.$

$v$ $j$ ${E}_{vj}^{D=3}$ ${E}_{vj}^{D=4}$ ${E}_{vj}^{D=5}$ ${E}_{vj}^{D=6}$
$0$ $0$ 3.998 389 2283.998 369 3743.998 336 0203.998 288 766
$1$ $0$ 3.985 503 0493.985 443 6113.985 344 2903.985 204 702
  $1$ 3.985 344 2903.985 204 7023.985 024 3083.984 802 416
$2$ $0$ 3.959 730 6923.959 631 6683.959 466 3813.959 234 459
  $1$ 3.959 466 3813.959 234 4593.958 935 3823.958 568 482
  $2$ 3.958 935 3823.958 568 4823.958 132 9443.957 627 808
$3$ $0$ 3.921 072 1563.920 933 5473.920 702 2943.920 378 038
  $1$ 3.920 702 2943.920 378 0383.919 960 2773.919 448 368
  $2$ 3.919 960 2773.919 448 3683.918 841 5263.918 138 822
  $3$ 3.918 841 5263.918 138 8223.917 339 1933.916 441 430
$4$ $0$ 3.869 527 4413.869 349 2483.869 052 0283.868 635 438
  $1$ 3.869 052 0283.868 635 4383.868 098 9943.867 442 076
  $2$ 3.868 098 9943.867 442 0763.866 663 9293.865 763 658
  $3$ 3.866 663 9293.865 763 6583.864 740 2393.863 592 508
  $4$ 3.864 740 2393.863 592 5083.862 319 1733.860 918 810

Table 5. Energy spectra ${E}_{vj}({\rm{in}}\,{\rm{eV}})$ of ${I}_{2}$ for arbitrary $v\,{\rm{and}}\,j$ quantum numbers at different dimensions with $\hslash c=1973.29\,{\rm{eV}}\mathring{\rm{A}} ,\,{{\rm{V}}}_{{\rm{1}}}=2,{{\rm{V}}}_{{\rm{2}}}=2,\,{{\rm{V}}}_{{\rm{3}}}=4\,{\rm{and}}\,{{\rm{V}}}_{{\rm{4}}}=-4.$

$v$ $j$ ${E}_{vj}^{D=3}$ ${E}_{vj}^{D=4}$ ${E}_{vj}^{D=5}$ ${E}_{vj}^{D=6}$
$0$ $0$ 3.999 885 5133.999 885 1383.999 884 5113.999 883 630
$1$ $0$ 3.998 969 6163.998 968 4913.998 966 6143.998 963 983
  $1$ 3.998 966 6143.998 963 9833.998 960 5953.998 956 447
$2$ $0$ 3.997 137 8233.997 135 9483.997 132 8203.997 128 439
  $1$ 3.997 132 8203.997 128 4393.997 122 8013.997 115 903
  $2$ 3.997 122 8013.997 115 9033.997 107 7403.997 098 308
$3$ $0$ 3.994 390 1343.994 387 5083.994 383 1303.994 376 999
  $1$ 3.994 383 1303.994 376 9993.994 369 1103.994 359 462
  $2$ 3.994 369 1103.994 359 4623.994 348 0493.994 334 866
  $3$ 3.994 348 0493.994 334 8663.994 319 9083.994 303 167
$4$ $0$ 3.990 726 5473.990 723 1713.990 717 5443.990 709 662
  $1$ 3.990 717 5443.990 709 6623.990 699 5233.990 687 124
  $2$ 3.990 699 5233.990 687 1243.990 672 4613.990 655 528
  $3$ 3.990 672 4613.990 655 5283.990 636 3193.990 614 829
  $4$ 3.990 636 3193.990 614 8293.990 591 0483.990 564 970

Furthermore, we represent equation (24) in 3-dimensions as follows (where $K\equiv J$ in 3-dimensions)

Equation (25)

For ${V}_{2}={V}_{4}=0,$ the generalized hyperbolic potential of equation (1) reduces to

Equation (26)

and its corresponding nonrelativisticro-vibrational energy spectra is obtained as

Equation (27)

The result in equation (27) is very consistent with [45, 50]. This results' accuracy have been tested by calculating the ro-vibrational energy spectra of the equation (27) numerically for different quantum states and various potential range,$\alpha .$ We have compared our result with other results obtained using different methods such as AIM [45] and algebraic method [50], as shown in table 6.

Table 6. Comparison of energy spectra ${E}_{vj}({\rm{in}}\,{\rm{eV}})$ for special case of generalized hyperbolic potential in D-dimensions for arbitrary quantum states with $\hslash =\mu =1,\,{{\rm{V}}}_{{\rm{1}}}=2,\,{\rm{and}}\,{{\rm{V}}}_{{\rm{3}}}=4.$

States $\alpha $ Present workAIM [45]Algebraic method [50]
$2p$ $0.05$ −3.575 101 020−3.575 101 016−3.575 101 02
  $0.10$ −3.166 384 390−3.166 384 378−3.166 384 38
  $0.15$ −2.773 782 467−2.773 782 451−2.773 782 46
  $0.20$ −2.397 227 654−2.397 227 633−2.397 227 65
  $0.25$ −2.036 652 400−2.036 652 376−2.036 652 40
$3p$ $0.05$ −3.246 181 840−3.246 181 829−3.246 181 83
  $0.10$ −2.543 491 901−2.543 491 882−2.543 491 90
  $0.15$ −1.891 808 441−1.891 808 414−1.891 808 44
  $0.20$ −1.291 009 778−1.291 009 744−1.291 009 77
  $0.25$ −0.740 974 322−0.740 974 285−0.740 974 32
$4p$ $0.05$ −2.927 262 658−2.927 262 642−2.927 262 65
  $0.10$ −1.960 599 413−1.960 599 387−1.960 599 41
  $0.15$ −1.099 834 416−1.099 834 381−1.099 834 41
  $0.20$ −0.344 791 902−0.344 791 861−0.344 791 90
  $0.25$ 0.304 703 75600.304 703 7980.304 703 753
$5d$ $0.05$ −2.771 553 066−2.771 553 048−2.771 553 06
  $0.10$ −1.684 153 169−1.684 153 139−1.684 153 17
  $0.15$ −0.737 597 4030−0.737 597 365−0.737 597 40
  $0.20$ 0.068 317 03600.068 317 0790.068 317 035
  $0.25$ 0.733 792 79400.733 792 8370.733 792 792

We also set ${V}_{1}\,=\,{V}_{3}\,=\,0$ to have hyperbolic Rosen-Morse potential from the GHP in the form

Equation (28)

The non-relativistic ro-vibrational energy spectra of the hyperbolic Rosen-Morse potential is obtained to be

Equation (29)

We also plot the graphs of the non-relativistic ro-vibrational energies with respect to the potential range, dimensions, rotational and vibrational quantum numbers, potential parameters, as shown in figures 18, respectively. From figures 14 respectively, it is seen that there is a monotonic decrease in the non-relativistic energies as $\alpha ,D,J,\,{\rm{and}}\,v$ increases for the selected diatomic molecules. Figures 5 and 6 show the increase in ${E}_{vJ}$ as the potential parameters ${V}_{1}\,{\rm{and}}\,{V}_{2}$ increases, respectively. In figures 7 and 8, the non-relativistic ro-vibrational energies increases to a peak value and later decreased as the potential parameters ${V}_{3}\,{\rm{and}}\,{V}_{4}$ increases, respectively. In addition, we considered the variation of ${E}_{vJ}$ with spatial dimension $D$ for various quantum states of $HCl$ molecule as shown in figure 9. As the spatial dimension increases, the non-relativistic ro-vibrational energy ${E}_{vJ}$ decreases slowly and later decreases in a monotonic manner. Figure 10 shows a sharp decrease in ${E}_{vJ}$ as the vibrational quantum number increases for different spatial dimensions of $HCl$ molecule.

Figure 1.

Figure 1. Nonrelativistic ro-vibrational energy versus $\alpha $ for various diatomic. Molecules and $v=1,\,J=0.$

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Figure 2.

Figure 2. Nonrelativistic ro-vibrational energy versus $D$ for various diatomic. Molecules and $v=1,\,J=0.$

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Figure 3.

Figure 3. Nonrelativistic ro-vibrational energy versus $J$ for various diatomic. Molecules and $v=1,\,D=3.$

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Figure 4.

Figure 4. Nonrelativistic ro-vibrational energy versus $v$ for various diatomic. Molecules and $D=3,\,J=0.$

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Figure 5.

Figure 5. Nonrelativistic ro-vibrational energy versus ${V}_{1}$ for various diatomic. Molecules and $v=1,\,J=0,\,D=3.$

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Figure 6.

Figure 6. Nonrelativistic ro-vibrational energy versus ${V}_{2}$ for various diatomic. Molecules and $v=1,\,J=0,\,D=3.$

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Figure 7.

Figure 7. Nonrelativistic ro-vibrational energy versus ${V}_{3}$ for various diatomic. Molecules and $v=1,\,J=0,\,D=3.$

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Figure 8.

Figure 8. Nonrelativistic ro-vibrational energy versus ${V}_{4}$ for various diatomic. Molecules and $v=1,\,J=0,\,D=3.$

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Figure 9.

Figure 9. Nonrelativistic ro-vibrational energy for $HCl$ molecule versus $D$ for. various quantum states.

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Figure 10.

Figure 10. Nonrelativistic ro-vibrational energy for $HCl$ molecule versus $v$ for. various $D$ and $J=1.$

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Conclusion

In our study, we solve the D-dimensional Klein–Gordon (KE) equation with our newly proposed generalized hyperbolic potential (GHP) model using the functional analysis method. By employing the Greene-Aldrich-like approximation scheme, we obtain an expression for the D-dimensional relativistic ro-vibrational energy spectra for the GHP. Also, this expression was reduced to the non-relativistic case by employing the necessary mapping scheme. Numerical results for the D-dimensional non-relativistic ro-vibrational energy spectra were obtained for different diatomic molecules ($HCl,\,NiC,\,CO,\,{I}_{2}$), for arbitrary quantum numbers. Special cases were obtained where our results agree with the results obtained in the literature. Our results for different diatomic molecules show inter-dimensional degeneracy symmetry as the dimensions increase and the rotational quantum number decreases. Different plots of non-relativistic ro-vibrational energy spectra versus the GHP parameters were also analyzed and discussed. These plots show a monotonic decrease in the energy eigenvalues as the potential parameters increase for the diatomic molecules considered. A specific consideration was given to $HCl$ molecule, as the variation of its non-relativistic ro-vibrational energy eigenvalues with both D-spatial dimension and vibrational quantum numbers, respectively, were discussed.

Acknowledgments

The authors thank the kind reviewers for the positive comments and suggestions that lead to an improvement of our manuscript

Appendix A

Equation (A.1)

Equation (A.2)

Equation (A.3)

Equation (A.4)

The standard integral is given as [32]

Equation (A.5)

Thus, the normalization constant can be found as

Equation (A.6)

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10.1088/2399-6528/ab42c6