Applications and resource estimates for open system simulation on a quantum computer

We study applications of a fully controllable open system quantum simulator. A universal quantum computer can realize such a simulator, and some classical methods can also approximate it. We introduce two concrete computational problems, such that finding their solution would have direct scientific or industrial utility. The scientific utility is exemplified by a computation of nonequilibrium behavior of Ca₃Co₂O₆, which has been studied in the costly MagLab experiments. Specifically, an order of \2M per material can be saved if an affordable quantum computer simulation is used to screen the materials before sending them to MagLab. For industrial utility, we develop a methodology that allows researchers of various backgrounds to estimate the economic value of an emerging technology consistently. We then apply our approach to the applications of materials with a Metal-Insulator Transition. These materials have not been used commercially yet, but many potential applications, including alternative transistors, neuromorphic computing, and smart windows, amount in total to \20M for the entire material search performed on a quantum computer. We provide zeroth-order resource estimates for both algorithms on superconducting qubit hardware, finding that simulating long-lifetime nonequilibrium effects presents a new challenge for quantum simulators. Finally, we introduce planted solution problems and their obfuscated versions to test the capabilities of the future quantum device. The intended use of those problems is to match the size of application benchmarks so that solving one guarantees the ability to solve the other.