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In this paper, we present the Quantum Information Software Developer Kit - Qiskit, for teaching quantum computing to undergraduate students, with basic knowledge of quantum mechanics postulates. We focus on presenting the construction of…

In this paper, we introduce HamilToniQ, an open-source, and application-oriented benchmarking toolkit for the comprehensive evaluation of Quantum Processing Units (QPUs). Designed to navigate the complexities of quantum computations,…

Quantum Physics · Physics 2024-04-23 Xiaotian Xu , Kuan-Cheng Chen , Robert Wille

Heterogeneous high-performance computing (HPC) systems offer novel architectures which accelerate specific workloads through judicious use of specialized coprocessors. A promising architectural approach for future scientific computations is…

Using quantum systems to efficiently solve quantum chemistry problems is one of the long-sought applications of near-future quantum technologies. In a recent work, ultra-cold fermionic atoms have been proposed for these purposes by showing…

Quantum Physics · Physics 2021-04-16 Javier Argüello-Luengo , Tao Shi , Alejandro González-Tudela

We introduce isQ, a new software stack for quantum programming in an imperative programming language, also named isQ. The aim of isQ is to make the programmers write quantum programs as conveniently as possible. In particular: 1) The isQ…

Quantum Physics · Physics 2023-11-22 Jingzhe Guo , Huazhe Lou , Riling Li , Wang Fang , Junyi Liu , Peixun Long , Shenggang Ying , Mingsheng Ying

We describe 'staq', a full-stack quantum processing toolkit written in standard C++. 'staq' is a quantum compiler toolkit, comprising of tools that range from quantum optimizers and translators to physical mappers for quantum devices with…

Quantum Physics · Physics 2020-08-07 Matthew Amy , Vlad Gheorghiu

We introduce a novel open-source software package QForte, a comprehensive development tool for new quantum simulation algorithms. QForte incorporates functionality for handling molecular Hamiltonians, fermionic encoding, ansatz…

Quantum Physics · Physics 2021-08-11 Nicholas H. Stair , Francesco A. Evangelista

We demonstrate the feasibility of quantum computing for large-scale, realistic chemical systems through the development of a new interface using a quantum circuit simulator and CP2K, a highly efficient first-principles calculation software.…

Chemical Physics · Physics 2025-06-24 Tomoya Shiota , Klaas Gunst , Toshio Mori , Toru Shiozaki , Wataru Mizukami

Computational micromagnetics requires numerical solution of partial differential equations to resolve complex interactions in magnetic nanomaterials. The Virtual Micromagnetics project described here provides virtual machine simulation…

Other Computer Science · Computer Science 2016-11-28 Mark Vousden , Marc-Antonio Bisotti , Maximilian Albert , Hans Fangohr

\textsc{Quantum Package} is an open-source programming environment for quantum chemistry specially designed for wave function methods. Its main goal is the development of determinant-driven selected configuration interaction (sCI) methods…

TensorCircuit is an open source quantum circuit simulator based on tensor network contraction, designed for speed, flexibility and code efficiency. Written purely in Python, and built on top of industry-standard machine learning frameworks,…

We present the Quantum Hamiltonian Analysis Toolkit (QHAT), a newly developed application that provides a user-friendly interface for studying Hamiltonians and performing Hamiltonian simulation on fault-tolerant quantum computers. QHAT…

Analog quantum simulators emulate complex many-body dynamics through native continuous-time evolution under hardware-defined interactions. Yet once a platform is specified, its interaction structure is largely fixed by the underlying…

Quantum Physics · Physics 2026-05-08 Yiming Huang , Jiaxing Song , Xiaoxia Cai , Xiao Yuan

QC Lab is an open-source Python package for QC dynamics simulations aimed to promote the development of QC algorithms, and their application to a wide variety of relevant model problems. It follows a modular design that facilitates…

Chemical Physics · Physics 2025-10-28 Alex Krotz , Ethan Byrd , Ken Miyazaki , Roel Tempelaar

Simulating quantum states on a classical computer is hard, typically requiring prohibitive resources in terms of memory and computational power. Efficient simulation, however, can be achieved for certain classes of quantum states, in…

Quantum Physics · Physics 2022-12-19 Igor Brandão , Daniel Tandeitnik , Thiago Guerreiro

We introduce QCLAB, an object-oriented MATLAB toolbox for constructing, representing, and simulating quantum circuits. Designed with an emphasis on numerical stability, efficiency, and performance, QCLAB provides a reliable platform for…

Quantum Physics · Physics 2025-03-06 Sophia Keip , Daan Camps , Roel Van Beeumen

Quantum simulators hold promise for solving many intractable problems. However, a major challenge in quantum simulation, and quantum computation in general, is to solve problems with limited physical hardware. Currently, this challenge is…

Quantum Physics · Physics 2025-04-15 Gal Gumpel , Jiwon Kang , Eliya Blumenthal , Aron Klevansky , Eunseong Kim , Shay Hacohen-Gourgy

Quantum simulation provides a powerful route for exploring many-body phenomena beyond the capabilities of classical computation. Existing approaches typically proceed in the forward direction: a model Hamiltonian is specified, implemented…

C++QED is a framework for simulating open quantum dynamics in general. Historically, it has in the first place been developed for problems in moving-particle cavity QED, but since then has been applied in other fields as well. It is known…

Quantum Physics · Physics 2010-04-27 Andras Vukics

We report the quantum computing of reacting flows by simulating the Hamiltonian dynamics. The scalar transport equation for reacting flows is transformed into a Hamiltonian system, mapping the dissipative and non-Hermitian problem in…

Fluid Dynamics · Physics 2024-07-30 Zhen Lu , Yue Yang