Entropy Production from Spin–Vibrational Coupling in Endohedral-Fullerene Qubits Encapsulated in Suspended Carbon Nanotubes

Hybrid carbon nanotube–fullerene architectures provide a controllable setting in which to study irreversibility and information flow in strongly structured quantum environments. We analyze entropy generation in a platform where paramagnetic endohedral fullerenes (PEFs), such as N@C60 and P@C60, are encapsulated inside a suspended carbon nanotube (CNT) resonator, such that selected multi-level PEF spin states define an effective qubit coupled to quantized CNT flexural modes. Motivated by prior work on fullerene-filled CNTs, on spin–phonon manipulation in suspended nanotubes, and on exact phase-space propagators for damped driven oscillators, we formulate a hybrid open-system description that combines a driven quantum Brownian description of the CNT resonator with an effective Jaynes–Cummings type spin–vibrational interaction. The resonator dynamics are represented in phase space through the Wigner function, whose time evolution can be written analytically in terms of the initial Wigner distribution and a Gaussian propagator. This representation makes it possible to separate drive-induced phase space displacement, diffusion, and damping, and to connect these features directly to entropy flow. The coupled spin–mechanical dynamics are then embedded in a Lindblad quantum master equation that includes mechanical damping, spin relaxation, pure dephasing, and thermally activated excitation channels. Within this framework we derive the entropy balance equation—identifying entropy flux and non-negative entropy production—and examine how hybridization between the molecular spin and the nanotube vibration redistributes irreversibility between coherent exchange and dissipative channels. We show that spin–phonon coupling enhanced by a magnetic field gradient, resonant driving, and moderate thermal occupation can produce identifiable crossovers between entropy–production regimes dominated by the oscillator and those dominated by the spin. The resulting framework provides a quantitative basis for using CNT–PEF hybrids as nanoscale platforms for studying nonequilibrium quantum thermodynamics, decoherence, and information loss in structured vibrational environments.