AWS Quantum Technologies Blog
Tag: Quantum Chemistry
Towards practical molecular electronic structure simulations on NISQ devices with Amazon Braket and Kvantify’s FAST-VQE algorithm
Quantum computing’s potential for computational chemistry is immense, but there are practical limitations. We show how Kvantify’s FAST-VQE algorithm can deliver great accuracy, performance, superior cost-effectiveness, driving us closer to transformative applications in drug discovery.
Running quantum chemistry calculations using AWS ParallelCluster
This blog post is an introduction to HPC on AWS for quantum computing researchers who are seeking to compare their quantum or hybrid algorithms against classical calculations.
Exploring quantum chemistry applications with Tangelo and QEMIST Cloud using Amazon Braket
In this post, we show how tools from our partner Good Chemistry can help you further explore the potential of quantum computing for non-trivial molecular systems, and design experiments that you can run on Amazon Braket.
Exploring computational chemistry using Quantinuum’s InQuanto on AWS
Introduction Quantum computers hold the promise of driving novel approaches to solving complex problems across multiple fields, including optimization, machine learning, and the simulation of physical systems. Researchers are already using quantum computers to explore computational chemistry problems, however the scale and capabilities of quantum devices available today is limited by noise and other factors. […]
Quantum Monte Carlo on Quantum Computers
In this blog post we develop a chemistry use case by augmenting classical algorithms for Quantum Monte Carlo with quantum computers. We will explain how to run these quantum-classical hybrid algorithms using Amazon Braket. You can find the code presented in this blog post in an accompanying Jupyter notebook. Overview Accurately determining the electronic energies […]
Improving analysis of the computational cost of quantum simulations for chemistry and material science
This post summarizes a recent research paper from the AWS Center for Quantum Computing. The paper provides an improved analysis of quantum simulation of chemical and material systems. This research shows that such simulations can be implemented using fewer elementary quantum operations than previously thought. Computer simulations enable scientists to test their intuition about the […]
Quantum Chemistry with Qu&Co’s (now Pasqal) QUBEC on Amazon Braket
(Update: Pasqal and Qu&Co announced a merger on January 11, 2022.) In this post, we discuss the progress and limitations of chemistry simulations on current quantum computers, and introduce Qu&Co‘s QUBEC, a quantum computational platform that is specifically designed for chemistry and materials science simulations. The post describes QUBEC’s architecture and how it integrates with […]