相关论文: Ro-vibrational spectroscopy of molecules represent…
Exact bound state solutions and corresponding normalized eigenfunctions of the radial Schr\"odinger equation are studied for the pseudoharmonic and Mie-type potentials by using the Laplace transform approach. The analytical results are…
In this study, we present the ro-vibrationally resolved gas-phase spectrum of the diatomic molecule TiO around 1000\,cm$^{-1}$. Molecules were produced in a laser ablation source by vaporizing a pure titanium sample in the atmosphere of…
Approximate analytical bound state solutions of the radial Schr\"odinger equation are studied for a two-term diatomic molecular potential in terms of the hypergeometric functions for the cases where $q\geq1$ and $q=0$. The energy…
We apply the asymptotic iteration method (AIM) to obtain the solutions of Schrodinger equation in the presence of Poschl-Teller (PT) potential. We also obtain the solutions of Dirac equation for the same potential under the condition of…
The generalized pseudospectral method is employed for the accurate calculation of eigenvalues, densities and expectation values for the spiked harmonic oscillators. This allows \emph{nonuniform} and \emph{optimal} spatial discretization of…
Analytic consideration of the Bohr-Oppenheimer (BO) approximation for diatomic molecules is proposed: accurate analytic interpolation for potential curve consistent with its rovibrational spectra is found. It is shown that in the…
The formulation of the eigenvalue problem for the Schr\"odinger equation is studied, for the numerical solution a new approach is applied. With the usual exponentially rising free-state asymptotical behavior, and also with a first order…
The spectra (rotational, rotation-vibrational or electronic) of diatomic molecules due to transitions involving only closed-shell ($^1\Sigma$) electronic states follow very regular, simple patterns and their theoretical analysis is usually…
Several alternative methods for description of interaction between rotation and vibration are compared and contrasted using hyper-spherical coordinates for a triatomic molecule. These methods differ by the choice of z-axis and by the…
Two physically important potentials (Manning-Rosen and P\"oschl-Teller) are considered for the ro-vibrational energy in diatomic molecules. An improved new approximation is invoked for the centrifugal term, which is then used for their…
Accurate ro-vibrational energies, eigenfunctions, radial densities, expectation values are presented for the exponential-type Manning-Rosen (MR) potential. Bound states accurate up to ten significant figure are obtained by employing a…
We present an approximate analytic solution of the Klein-Gordon equation in the presence of equal scalar and vector generalized deformed hyperbolic potential functions by means of parameteric generalization of the Nikiforov-Uvarov method.…
Accurate experimental values for the vibrational ground tone or fundamental vibrational energy splitting of H$_2$, HD, and D$_2$ are presented. Absolute accuracies of $2\times10^{-4}$ cm$^{-1}$ are obtained from Doppler-free laser…
In this study, we employ exact quantization rule (EQR) to derive the analytical approximate l-wave solutions of the Schrodinger equation with the general molecular oscillator (GMO). The energy eigenvalues equation and the corresponding wave…
We investigate the dynamics of a rotating Morse wave packet, appropriate for a ro-vibrating diatomic molecule. The coupling between vibrational and rotational degrees of freedom is explicated in real position space as well as in phase space…
The spectrum of r-1 and r-2 type potentials of diatomic molecules in radial Schrodinger equation are calculated by using the formalism of asymptotic iteration method. The alternative method is used to solve eigenvalues and eigenfunctions of…
For non-zero $\ell$ values, we present an analytical solution of the radial Schr\"{o}dinger equation for the rotating Morse potential using the Pekeris approximation within the framework of the Asymptotic Iteration Method. The bound state…
Accurate solution of the Schr\"odinger equation with Deng-Fan potential is presented by means of Nikiforov-Uvarov method. A modified Pekeris-type approximation is proposed for the centrifugal term, from a linear combination of the $r \to 0$…
In this work we study the last two hydrogen molecular ion isotopologues: DT$^+$ and T$_2^+$, for which high-precision calculations have not yet been made. We obtain the nonrelativistic solutions of the Schr\"odinger equation for the wide…
An analytical representation for the potential energy curve for the ground state $X^1\Sigma^+$ of the hydrogen fluoride molecule (HF) is presented in the frame of the Born-Oppenheimer approximation. The analytical expression for the…