Quantum Chemistry Research Repository

Access in-depth studies on molecular simulations, electronic structure theories, and quantum computational advancements

Research Articles

Seeing Chemical Bonds: How a Breathing Orbital Method Reveals Acetylene's Secrets

Discover how the Breathing Orbital Valence Bond method combined with Diffusion Monte Carlo provides unprecedented insight into acetylene's C-H bond dissociation.

Layla Richardson
Nov 01, 2025

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