A theoretical investigation for the feasibility of laser-cooling is performed through the
calculation of accurate potential energy curves, static dipole moments, spectroscopic …

The potential energy curves (PECs) and transition dipole moments of four electronic states
of the CaI molecule are obtained by the multireference configuration interaction method and …

Rotation–vibration bands of CaH and CaD were observed in the 10 μm region using a diode
laser spectrometer. The calcium hydride was produced in a dc discharge of H2/D2 over …

The equilibrium properties and potential energy curves of the ground electronic state of CaF
have been calculated using the Brueckner Doubles calculation with a triples contribution …

We apply our recently developed, quantum, nonadiabatic, two-dimensional finite element
method [Warehime, J. Chem. Phys. 142, 034108 (2015). JCPSA6 0021-9606 …

The calcium monofluoride (CaF) molecule has emerged as a promising candidate for
precision measurements, quantum simulation, and ultracold chemistry experiments. Inelastic …

The high-resolution vibration-rotation emission spectrum of the 2 Σ+ ground state of calcium
hydride has been recorded with a Bruker Fourier transform spectrometer. The gas-phase …

A variety of theoretical procedures, including the high-level ab initio methods G3, G3
[CC](dir, full), and W2C//ACQ, have been used to predict the structures and heats of …

The potential energy curves (PECs) of the ground and five low-lying excited states of CaF
have been calculated using the internally contracted multireference configuration interaction …

In order to represent the potential energy function over the whole range of R, many empirical
potential energy functions have been proposed, by which one can determine certain …