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The Message-Passing Interface (MPI) and C++ form the backbone of high-performance computing, but MPI only provides C and Fortran bindings. While this offers great language interoperability, high-level programming languages like C++ make…

分布式、并行与集群计算 · 计算机科学 2024-11-13 Tim Niklas Uhl , Matthias Schimek , Lukas Hübner , Demian Hespe , Florian Kurpicz , Christoph Stelz , Peter Sanders

We present a wide-reaching revamp of the generalized many-body expanded full configuration interaction (MBE-FCI) method. First, we outline how to automatize the selection of reference active spaces whereby the inherent bias introduced…

化学物理 · 物理学 2024-06-18 Jonas Greiner , Jürgen Gauss , Janus J. Eriksen

OpenSBLI is an open-source code-generation system for compressible fluid dynamics (CFD) on heterogeneous computing architectures. Written in Python, OpenSBLI is an explicit high-order finite-difference solver on structured curvilinear…

计算物理 · 物理学 2021-07-14 David J. Lusher , Satya P. Jammy , Neil D. Sandham

Full configuration interaction quantum Monte Carlo (FCIQMC) is a state-of-the-art stochastic electronic structure method, providing a methodology to compute FCI-level state energies of molecular systems within a quantum chemical basis.…

化学物理 · 物理学 2022-04-29 Tonghuan Jiang , Wei Fang , Ali Alavi , Ji Chen

Bipartite quantum interactions have applications in a number of different areas of quantum physics, reaching from fundamental areas such as quantum thermodynamics and the theory of quantum measurements to other applications such as quantum…

量子物理 · 物理学 2018-12-21 Stefan Bäuml , Siddhartha Das , Mark M. Wilde

Quantum Chemistry (QC) is one of the most promising applications of Quantum Computing. However, present quantum processing units (QPUs) are still subject to large errors. Therefore, noisy intermediate-scale quantum (NISQ) hardware is…

量子物理 · 物理学 2025-10-21 Mohammad Haidar , Marko J. Rančić , Thomas Ayral , Yvon Maday , Jean-Philip Piquemal

The openQ*D code for the simulation of QCD+QED with C$^\star$ boundary conditions is presented. This code is based on openQCD-1.6, from which it inherits the core features that ensure its efficiency: the locally-deflated SAP-preconditioned…

We describe an opto-electronic structure in which charge and spin degrees of freedom in electrical gate-defined quantum dots can be coherently coupled to light. This is achieved via electron-electron interaction or via electron tunneling…

介观与纳米尺度物理 · 物理学 2007-05-23 Hans-Andreas Engel , Jacob M. Taylor , Mikhail D. Lukin , Atac Imamoglu

Software-defined networking offers a device-agnostic programmable framework to encode new network functions. Externally centralized control plane intelligence allows programmers to write network applications and to build functional network…

量子物理 · 物理学 2016-05-25 Venkat R. Dasari , Ronald J. Sadlier , Ryan Prout , Brian P. Williams , Travis S. Humble

We present a unified C++ implementation of the functional renormalization group and the parquet equations within the single-boson exchange formalism for several paradigmatic tight-binding and impurity models at equilibrium. The…

强关联电子 · 物理学 2026-04-07 Aiman Al-Eryani , Miriam Patricolo , Kilian Fraboulet

This dissertation explores quantum computation using qudits encoded into large spins, emphasizing the concept of quantum co-design to harness the unique capabilities of physical platforms for enhanced quantum information processing. First,…

量子物理 · 物理学 2024-05-14 Sivaprasad Omanakuttan

OpenCL is an open standard for parallel programming of heterogeneous compute devices, such as GPUs, CPUs, DSPs or FPGAs. However, the verbosity of its C host API can hinder application development. In this paper we present cf4ocl, a…

分布式、并行与集群计算 · 计算机科学 2017-05-16 Nuno Fachada , Vitor V. Lopes , Rui C. Martins , Agostinho C. Rosa

We propose doubly occupied configuration interaction-quantum selected configuration interaction (DOCI-QSCI), which samples from the seniority-zero space. While the use of this space effectively doubles the qubit budget, equaling the number…

We introduce a framework for realizing universal fermionic quantum processing with globally controlled itinerant fermionic particles. Our approach is tailored to the example of neutral atoms in optical lattices, but transposes to other…

We present a universal fault-tolerant quantum computing architecture based on identical particle qubits (IPQs), where we find that the first-order IPQ - bath interaction fundamentally differs from the conventional first-order qubit-bath…

量子物理 · 物理学 2026-02-25 S. L. Wu , Lian-Ao Wu

We propose an all-optical implementation of quantum-information processing in semiconductor quantum dots, where electron-hole excitations (excitons) serve as the computational degrees of freedom (qubits). We show that the strong dot…

量子物理 · 物理学 2009-11-06 Filippo Troiani , Ulrich Hohenester , Elisa Molinari

We review quantum information processing with cold neutral particles, that is, atoms or polar molecules. First, we analyze the best suited degrees of freedom of these particles for storing quantum information, and then we discuss both…

量子物理 · 物理学 2011-11-01 Antonio Negretti , Philipp Treutlein , Tommaso Calarco

Applications written in low-level languages without type or memory safety are especially prone to memory corruption. Attackers gain code execution capabilities through such applications despite all currently deployed defenses by exploiting…

密码学与安全 · 计算机科学 2014-07-03 Mathias Payer , Antonio Barresi , Thomas R. Gross

The wide spread of click-and-mortar model offers an opportunity to consider a universal commercial interaction method. However, issues like privacy protection resist the widespread acceptance. Traditional SET and SSL protocols are designed…

密码学与安全 · 计算机科学 2021-12-07 Mausumi Das Nath , Tapalina Bhattasali

We provide a spin-adapted formulation of the Full Configuration Interaction Quantum Monte Carlo (FCIQMC) algorithm, based on the Graphical Unitary Group Approach (GUGA), which enables the exploitation of SU(2) symmetry within this…

化学物理 · 物理学 2019-09-10 Werner Dobrautz , Simon Smart , Ali Alavi