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Feshbach Resonances in Cold Collisions: Benchmarking State of the Art ab initio Potential Energy Surfaces

Feshbach Resonances in Cold Collisions: Benchmarking State of the Art ab initio Potential Energy Surfaces

来源:Arxiv_logoArxiv
英文摘要

High-quality potential energy surfaces (PES) are a prerequisite for quantitative atomistic simulations, with both quantum and classical dynamics approaches. The ultimate test for the validity of a PES are comparisons with judiciously chosen experimental observables. Here we ask whether cold collision measurements are sufficiently informative to validate and distinguish between high-level, state-of-the art PESs for the strongly interacting Ne-H$_2^+$ system. We show that measurement of the final state distributions for a process that involves only several metastable intermediate states is sufficient to identify the PES that captures the long-range interactions properly. Furthermore, we show that a modest increase in the experimental energy resolution will allow for resolving individual Feshbach resonances and enable a quantitative probe of the interactions at short and intermediate range.

Baruch Margulis、Christiane P. Koch、Meenu Upadhyay、Karl P. Horn、Daniel M. Reich、Edvardas Narevicius、Markus Meuwly

10.1021/acs.jpclett.5c01581

物理学

Baruch Margulis,Christiane P. Koch,Meenu Upadhyay,Karl P. Horn,Daniel M. Reich,Edvardas Narevicius,Markus Meuwly.Feshbach Resonances in Cold Collisions: Benchmarking State of the Art ab initio Potential Energy Surfaces[EB/OL].(2025-07-28)[2025-08-06].https://arxiv.org/abs/2408.13197.点此复制

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