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Fanhou Wang

As seen in: Journal of Chemical Physics
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Articles

Laser cooling of the AlCl molecule with a three-electronic-level theoretical model

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By You Yu, Axel D. Becke, Mingjie Wan, Chengguo Jin, Fanhou Wang, Yujie Yang
| Journal of Chemical Physics Verified
Feasibility of laser-cooling AlCl molecule is investigated using ab initio quantum chemistry. Potential energy curves, permanent dipole moments, and transition dipole moments for the X 1Σ+, a 3Π, and A 1Π states are studied based on multi-reference configuration interaction plus Davidson corrections (MRCI+Q) method with ACVQZ basis set, spin-orbit coupling effects are considered at the MRCI+Q level.
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