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arxiv: 1804.04660 · v1 · pith:MYRI3R4Enew · submitted 2018-04-12 · ⚛️ physics.chem-ph · math-ph· math.MP· quant-ph

Multiple Superadiabatic Transitions and Landau-Zener Formulas

classification ⚛️ physics.chem-ph math-phmath.MPquant-ph
keywords fullavoidedcrossingslandau-zenermultiplesinglesystemstransitions
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We consider nonadiabatic systems in which the classical Born-Oppenheimer approximation breaks down. We present a general theory that accurately captures the full transmitted wavepacket after multiple transitions through either a single or distinct avoided crossings, including phase information and associated interference effects. Under suitable approximations, we recover both the celebrated Landau-Zener formula and standard surface-hopping algorithms. Our algorithm shows excellent agreement with the full quantum dynamics for a range of avoided crossing systems, and can also be applied to single full crossings with similar accuracy.

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