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QMD simulation
Legacy

Quantum Molecular Dynamics

A new algorithm for use with first-principles molecular dynamics codes enables the number of atoms simulated to be proportional to the number of processors available.

closeup of displacement rendering

Serpentine Wave Propagation

These methods for solving hyperbolic wave propagation problems allow for complex geometries, realistic boundary and interface conditions, and arbitrary heterogeneous material properties.

rainbow colored swirl on adaptive mesh

BLAST

BLAST is a high-order finite element hydrodynamics research code that improves the accuracy of simulations and provides a path to extreme parallel computing and exascale architectures.

NEWS
3D simulation of a shock interaction that looks like a colorful cylinder peeling back at one end

ECP co-design center wraps up seven years of collaboration

The Center for Efficient Exascale Discretizations has developed innovative mathematical algorithms for the DOE’s next generation of supercomputers.

meeting attendees posed as a group outside UCLCC

Meeting of the minds: advanced math for the exascale era

Hosted at LLNL, the Center for Efficient Exascale Discretizations’ annual event featured breakout discussions, more than two dozen speakers, and an evening of bocce ball.

brightly multi-colored circle on a dark blue background

CASC Newsletter | Vol 13 | July 2023

This issue highlights some of CASC’s contributions to making controlled laboratory fusion possible at the National Ignition Facility.