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Conversion units in NaI potential #193

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JanosJiri opened this issue Nov 30, 2024 · 0 comments · Fixed by #194
Closed

Conversion units in NaI potential #193

JanosJiri opened this issue Nov 30, 2024 · 0 comments · Fixed by #194
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An incorrect conversion of nonadiabatic couplings in the NaI potential. The error in populations was compensated by too strong default decoherence correction which resulted in the same transfer as in QD. When the decoherence correction is set correctly, the error with unit conversion appears.
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Correcting NaI conversion units for NAC PHOTOX/ABIN
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