The Pauli principle and nuclear spin isomers of ammonia molecules significantly reshape collective light-matter coupling in infrared cavities, demonstrated via numerical simulations for two molecules and an analytical model for ensembles.
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Numerical tests on coupled oscillator models show that the local diabatic representation converges faster than the Born-Huang approach for strong vibronic couplings.
Compares Lindblad, stochastic Schrödinger, and non-Hermitian methods for dissipative Na2-cavity dynamics and shows rotational nonadiabatic effects.
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Nuclear Spin Isomers and the Pauli Principle in Polaritonic Chemistry
The Pauli principle and nuclear spin isomers of ammonia molecules significantly reshape collective light-matter coupling in infrared cavities, demonstrated via numerical simulations for two molecules and an analytical model for ensembles.
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Exponential convergence of the local diabatic representation for nonadiabatic models
Numerical tests on coupled oscillator models show that the local diabatic representation converges faster than the Born-Huang approach for strong vibronic couplings.