2 papers
quant-ph2026
Quantum simulation of nanographenes and Trotter error cancellation
Andreas Juul Bay-Smidt, Nina Glaser, Marcel D. Fabian +3
Fault-tolerant quantum computing is a promising tool for simulating molecules and materials, but frequently-considered applications require substantial resources, and the gap betwe…
physics.chem-ph2025
The PPP model - a minimal viable parametrisation of conjugated chemistry for modern computing applications
Marcel David Fabian, Nina Glaser, Gemma C. Solomon
The semi-empirical Pariser-Parr-Pople (PPP) Hamiltonian is reviewed for its ability to provide a minimal model of the chemistry of conjugated -electron systems, and its current…