Search

Noncovalent interactions are a key ingredient to determine the structure, stability, and dynamics of materials, molecules, and biological complexes. However, accurately capturing these interactions is a complex quantum many-body problem, with no efficient solution available on classical computers. A widely used model to accurately and efficiently model noncovalent interactions is the Coulomb-coupled quantum Drude oscillator (cQDO) many-body Hamiltonian, for which no exact solution is known. We show that the cQDO model lends itself naturally to simulation on a photonic quantum computer, and we calculate the binding energy curve of diatomic systems by leveraging Xanadu's strawberry fields photonics library. Our study substantially extends the applicability of quantum computing to atomistic modeling by showing a proof-of-concept application to noncovalent interactions, beyond the standard electronic-structure problem of small molecules. Remarkably, we find that two coupled bosonic QDOs exhibit a stable bond. In addition, our study suggests efficient functional forms for cQDO wave functions that can be optimized on classical computers, and capture the bonded-to-noncovalent transition for increasing interatomic distances.

Abstract Recently, the modular linear differential equation (MLDE) for level-two congruence subgroups Γ θ , Γ0(2) and Γ0(2) of SL2(ℤ) was developed and used to classify the fermionic rational conformal field theories (RCFT). Two character solutions of the second-order fermionic MLDE without poles were found and their corresponding CFTs are identified. Here we extend this analysis to explore the landscape of three character fermionic RCFTs obtained from the third-order fermionic MLDE without poles. Especially, we focus on a class of the fermionic RCFTs whose Neveu-Schwarz sector vacuum character has no free-fermion currents and Ramond sector saturates the bound h R ≥ C 24 $$ \frac{C}{24} $$ , which is the unitarity bound for the supersymmetric case. Most of the solutions can be mapped to characters of the fermionized WZW models. We find the pairs of fermionic CFTs whose characters can be combined to produce K(τ), the character of the c = 12 fermionic CFT for Co0 sporadic group.

Abstract The aim of this note is to point out an interesting fact related to the elliptic genus of complex algebraic surfaces in the context of Mathieu moonshine. We also discuss the case of 4-folds.

Abstract We study Heterotic supergravity on Hyper-Kähler manifolds in the presence of non-trivial warping and three form flux with Abelian bundles in the large charge limit. We find exact, regular solutions for multi-centered Gibbons-Hawking spaces and Atiyah-Hitchin manifolds. In the case of Atiyah-Hitchin, regularity requires that the circle at infinity is of the same order as the instanton number, which is taken to be large. Alternatively there may be a non-trivial density of smeared five branes at the bolt.

Abstract We compute the one-loop threshold corrections to the gauge and gravitational couplings for a large class of N = 2 $$ \mathcal{N}=2 $$ non-Kähler heterotic compactifications with three-form flux, consisting in principal two-torus bundles over K3 surfaces. We obtain the results as sums of BPS-states contributions, depending on the topological data of the bundle. We analyse also the worldsheet non-perturbative corrections coming from instantons wrapping the torus fiber, that are mapped under S-duality to D-instanton corrections in type I flux compactifications.