2 citations · 3 across the 4 of their papers we have counts for
5 papers
Majorana Zero Modes Emulated in a Magnetic Molecule Chain
Silas Hoffman, Jie-Xiang Yu, Shuang-Long Liu +6
We propose molecular magnets as a platform to emulate Majorana zero modes (MZMs). Using a quantum chemistry approach, we identify several candidates and predict a Co trimer to have…
Long-Range Magnetic Exchange Pathways in Complex Clusters from First-Principles
Dian-Teng Chen, Jia Chen, Xiang-Guo Li +3
This work builds a bridge between density functional theory (DFT) and model interpretations of Anderson's superexchange theory by constructing a -- model with DFT Wannier…
Decoherence in Molecular Electron Spin Qubits: Insights from Quantum Many-Body Simulations
Jia Chen, Cong Hu, John F. Stanton +3
Quantum states are described by wave functions whose phases cannot be directly measured, but which play a vital role in quantum effects such as interference and entanglement. The l…
Three Jahn-Teller states of matter in the spin-crossover system Mn(taa)
Jie-Xiang Yu, Dian-Teng Chen, Jie Gu +7
Three high-spin phases recently discovered in the spin-crossover system Mn(taa) are identified through analysis by a combination of first-principles calculations and Monte Carlo si…
Formation energies of charged defects in two-dimensional materials -- resolution of long-standing difficulties
Andrew O'Hara, Blair R. Tuttle, Xiao-Guang Zhang +1
Formation energies of charged point defects in semiconductors are calculated using periodic supercells, which entail a divergence arising from long-range Coulombic interactions. Th…