In this duo presentation, we will explore the promising impact of quantum computing on chemistry through QC2, a software that connects quantum chemistry with quantum computers. The first part will provide an overview of the need for quantum computing in chemistry, using real-world applications to illustrate its potential. We will also touch on recent advancements in drug and materials discovery, along with the opportunities and challenges posed by current NISQ quantum hardware. Finally, we will discuss the progress toward fault-tolerant systems, with the expectation of reaching over 100 logical qubits in the near future.
In the second part, we will present QC2’s modular framework, which seamlessly integrates quantum chemistry tools like PySCF and PSI4 with quantum computing platforms. This innovation streamlines quantum-enhanced simulations in the near term, enabling chemists and researchers to use cutting-edge quantum algorithms without the need to manage complex pre- and post-processing steps. The software is versatile, compatible with any quantum chemistry software, and integrates seamlessly with any quantum software development kit. Join us as we explore how these advancements are reshaping the future of quantum chemistry on quantum computers, making it accessible and user-friendly for computational chemists in both academia and industry, regardless of their expertise in quantum computing.