# Benchmarking VQE Configurations: Architectures, Initializations, and Optimizers for Silicon Ground State Energy

arXiv: https://arxiv.org/abs/2510.23171 · HTML: https://mlsanity.com/paper/2510.23171/

## Key facts

- No citing papers in the map yet (data through 14 Oct 2026).
- Builds on 5 of its 59 references that are in the map.
- First posted on arXiv 27 Oct 2025.

## Builds on (most cited first, 5 of 5)

- [Adam: A Method for Stochastic Optimization](https://mlsanity.com/paper/1412.6980/) (2014)
- [An overview of gradient descent optimization algorithms](https://mlsanity.com/paper/1609.04747/) (2016)
- [Variational Quantum Algorithms](https://mlsanity.com/paper/2012.09265/) (2020)
- [Barren Plateaus in Variational Quantum Computing](https://mlsanity.com/paper/2405.00781/) (2024)
- [Variational Quantum Algorithms for Chemical Simulation and Drug Discovery](https://mlsanity.com/paper/2211.07854/) (2022)

## Abstract (arXiv)

Quantum computing presents a promising path toward precise quantum chemical simulations, particularly for systems that challenge classical methods. This work investigates the performance of the Variational Quantum Eigensolver (VQE) in estimating the ground-state energy of the silicon atom, a relatively heavy element that poses significant computational complexity. Within a hybrid quantum-classical optimization framework, we implement VQE using a range of ansatz, including Double Excitation Gates, ParticleConservingU2, UCCSD, and k-UpCCGSD, combined with various optimizers such as gradient descent, SPSA, and ADAM. The main contribution of this work lies in a systematic methodological exploration of how these configuration choices interact to influence VQE performance, establishing a structured benchmark for selecting optimal settings in quantum chemical simulations. Key findings show that parameter initialization plays a decisive role in the algorithm's stability, and that the combination of a chemically inspired ansatz with adaptive optimization yields superior convergence and precision compared to conventional approaches.