Quantum algorithm for photodissociation wavefunction propagation on quantum computers via split-operator, QFT, dilated non-unitary absorber, and Hadamard-test autocorrelation, matching benchmarks on NOCl under ideal conditions with noise robustness.
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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.
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Quantum Mechanical Studies of Photodissociation Dynamics on Quantum Computers
Quantum algorithm for photodissociation wavefunction propagation on quantum computers via split-operator, QFT, dilated non-unitary absorber, and Hadamard-test autocorrelation, matching benchmarks on NOCl under ideal conditions with noise robustness.