Research Articles
Simulating Dynamic Excitons Via Quantum Molecular Dynamics: A Case Study in Lead Halide Perovskites
Explore how quantum molecular dynamics simulations reveal the fascinating behavior of excitons in lead halide perovskites, enabling breakthroughs in solar energy and optoelectronics.
Unfolding the Universe: How Tensor Decomposition Solves Chemistry's Most Complex Puzzles
Explore how tensor decomposition revolutionizes computational chemistry by solving previously intractable chemical problems through multidimensional data analysis.
Catching Electrons in Motion: How TDDFT Reveals Nature's Fastest Processes
Explore how Time-Dependent Density Functional Theory revolutionizes our understanding of electron dynamics and nonadiabatic processes in quantum systems.
Beyond the Blur: Capturing the Atomic Dance of Light and Matter
How ultrafast electron diffraction reveals the quantum choreography of atoms and electrons during chemical reactions