@article{abb9c113416548de8e72c5496c9ddbb1,
title = "A computational quantum-mechanical model of a molecular magnetic trap",
abstract = "A model for describing the states of a molecular system trapped in a cavity created by a fast-rotating strong magnetic field is proposed and implemented. All-particle explicitly correlated Gaussian functions with shifted centers are employed in the model to expand the wave functions of the system. Both “internal” states associated with the system{\textquoteright}s rovibrational and electronic motions and the “external” states associated with translational motion of the center of mass of the system in the cavity are calculated. The states are visualized by density plots. The model is applied to a trapped HD molecule.",
author = "Ludwik Adamowicz and Monika Stanke and Erik Tellgren and Trygve Helgaker",
note = "Funding Information: This work was supported by the Norwegian Research Council through its Centres of Excellence Scheme (Project No. 262695) and through the European Research Council under the European Union Seventh Framework Program through the Advanced Grant ABACUS, ERC Grant Agreement No. 267683. This work was also supported by funds from the Polish National Science Centre granted on the basis of Decision No. DEC-2013/10/E/ST4/00033 and by the National Science Foundation, Grant No. IIA-1444127. L.A. thanks CTCC for supporting his visits to Oslo. We would like to thank Dr. Alex Borgoo for his assistance with the density plots. The ECG basis sets generated in this work for expanding the wave function of the global and internal states are available from the authors upon request. Publisher Copyright: {\textcopyright} 2018 Author(s).",
year = "2018",
month = dec,
day = "28",
doi = "10.1063/1.5055767",
language = "English (US)",
volume = "149",
journal = "Journal of Chemical Physics",
issn = "0021-9606",
publisher = "American Institute of Physics Publising LLC",
number = "24",
}