Quantum Chemistry Research Repository

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

Research Articles

Breaking the Time Barrier: The Quest to Simulate Nature in Quantum Detail

Explore how strong scaling in molecular dynamics simulations is revolutionizing our ability to observe atomic processes with quantum accuracy.

Lillian Cooper
Nov 13, 2025

The Quantum Compass: How Digital Simulations Guide Us to Sustainable Fuels and Chemicals

Explore how Density Functional Theory (DFT) accelerates sustainable energy research through quantum simulations of solar cells, batteries, and catalysts.

Mia Campbell
Oct 27, 2025

Quantum Ordering: A Clever Trick to Tame Quantum Errors

Discover how optimized quantum program execution ordering can significantly reduce errors in quantum simulations without hardware changes.

Grayson Bailey
Oct 13, 2025

Beyond Silicon: Trapped Ions Unlock the Quantum Secrets of Molecules

How trapped-ion quantum simulators are revolutionizing quantum chemistry calculations by solving problems impossible for classical computers.

Michael Long
Aug 08, 2025

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