Related papers: Gutzwiller wave function on a quantum computer usi…
In this work, we develop a novel mathematical framework for universal digital quantum computation using algebraic probability theory. We rigorously define quantum circuits as finite sequences of elementary quantum gates and establish their…
Applications of quantum simulation algorithms to obtain electronic energies of molecules on noisy intermediate-scale quantum (NISQ) devices require careful consideration of resources describing the complex electron correlation effects. In…
We present a quantum-classical hybrid random power method that approximates a ground state of a Hamiltonian. The quantum part of our method computes a fixed number of elements of a Hamiltonian-matrix polynomial via quantum polynomial…
We apply two ab initio many-body methods based on Gutzwiller wave functions, i.e., correlation matrix renormalization theory (CMRT) and Gutzwiller conjugate gradient minimization (GCGM), to the study of crystalline phases of atomic…
The Box-Muller transform is a widely used method to generate Gaussian samples from uniform samples. Quantum amplitude encoding methods encode the multi-variate normal distribution in the amplitudes of a quantum state. This work presents the…
The Jordan-Wigner transformation maps a one-dimensional spin-1/2 system onto a fermionic model without spin degree of freedom. A double chain of quantum bits with XX and ZZ couplings of neighboring qubits along and between the chains,…
We present a method to compute pairing fluctuations on top of the Gutzwiller approximation (GA). Our investigations are based on a charge-rotational invariant GA energy functional which is expanded up to second order in the pair…
We present a quantum-classical algorithm to study the dynamics of the two-spatial-site Schwinger model on IBM's quantum computers. Using rotational symmetries, total charge, and parity, the number of qubits needed to perform computation is…
In digital quantum simulation of fermionic models with qubits, non-local maps for encoding are often encountered. Such maps require linear or logarithmic overhead in circuit depth which could render the simulation useless, for a given…
We transform the quartic Hubbard terms in the extended Hubbard model to a quadratic form by making the Hubbard-Stratonovich transformation for the electron operators. This transformation allows us to derive exact results for mass operator…
Quantum computers have the potential to simulate chemical systems beyond the capability of classical computers. Recent developments in hybrid quantum-classical approaches enable the determinations of the ground or low energy states of…
We propose a novel hybrid quantum-classical approach to calculate Graver bases, which have the potential to solve a variety of hard linear and non-linear integer programs, as they form a test set (optimality certificate) with very appealing…
Quantum computers have a potential for solving quantum chemistry problems with higher accuracy than classical computers. Quantum computing quantum Monte Carlo (QC-QMC) is a QMC with a trial state prepared in quantum circuit, which is…
The Variational Quantum Eigensolver approach to the electronic structure problem on a quantum computer involves measurement of the Hamiltonian expectation value. Formally, quantum mechanics allows one to measure all mutually commuting or…
The many-body dynamics of a quantum computer can be reduced to the time evolution of non-interacting quantum bits in auxiliary fields by use of the Hubbard-Stratonovich representation of two-bit quantum gates in terms of one-bit gates. This…
Gutzwiller's trace formula and Bogomolny's formula are applied to a non--specific, non--scalable Hamiltonian system, a two--dimensional anharmonic oscillator. These semiclassical theories reproduce well the exact quantal results over a…
Simulations of quantum matter rely mainly on Kohn-Sham density functional theory (DFT), which often fails for strongly correlated systems. Quantum embedding (QE) theories address this limitation by mapping the system onto an auxiliary…
The complex-scaling method can be used to calculate molecular resonances within the Born-Oppenheimer approximation, assuming the electronic coordinates are dilated independently of the nuclear coordinates. With this method, one will…
In the periodic orbit quantization of physical systems, usually only the leading-order hbar contribution to the density of states is considered. Therefore, by construction, the eigenvalues following from semiclassical trace formulae…
The quantum Fourier transform (QFT) is a key ingredient of several quantum algorithms and a qudit-specific implementation of the QFT is hence an important step toward the realization of qudit-based quantum computers. This work develops a…