Discoveries in quantum materials, which are characterized by the strongly quantum-
mechanical nature of electrons and atoms, have revealed exotic properties that arise from …

The simulation of strongly correlated many-electron systems is one of the most promising
applications for near-term quantum devices. Here we use a class of eigenvalue solvers …

Quantum chemistry can explain and predict many properties of molecules and materials.
However, there are some systems, among which are magnetic systems, that remain a …

A ring-shaped carbon allotrope was recently synthesized for the first time, reinvigorating
theoretical interest in this class of molecules. The dual π structure of these molecules allows …

The accurate description of biradical systems, and in particular the resolution of their singlet–
triplet gaps, has long posed a major challenge to the development of electronic structure …

An outstanding challenge in chemical computation is the many-electron problem where
computational methodologies scale prohibitively with system size. The energy of any …

The synthesis and design of organic biradicals with tunable singlet–triplet gaps have
become the subject of significant research interest, owing to their possible photochemical …

An outstanding challenge in synthesis and theory is to develop molecular materials at
ambient conditions that exhibit highly efficient energy transfer. Here we demonstrate the …

Exciton condensation, a Bose–Einstein condensation of excitons into a single quantum
state, has recently been achieved in low-dimensional materials including twin layers of …

A donor–acceptor conjugated copolymer containing thienothiophene (donor) units and Co
(II) complexes (acceptor) has been synthesized and characterized. The studies of magnetic …