Mar 8, 2009 · In this paper we present high performance data-parallel algorithms for computing MOs on multi-core. CPUs and GPUs and details of their ...

We present novel data-parallel algorithms for computing lattices of MOs on modern graphics processing units (GPUs) and multi-core CPUs. The fastest GPU ...

Mar 8, 2009 · Computing Molecular Orbitals. • Calculation of high resolution MO grids can require tens to hundreds of seconds in existing tools.

We present novel data-parallel algorithms for computing lattices of MOs on modern graphics processing units (GPUs) and multi-core CPUs. The fastest GPU ...

We present novel data-parallel algorithms for computing lattices of MOs on modern graphics processing units (GPUs) and multi-core CPUs. The fastest GPU ...

Bibliographic details on High performance computation and interactive display of molecular orbitals on GPUs and multi-core CPUs.

High performance computation and interactive display of molecular orbitals on GPUs and multi-core CPUs. Publication Year: 2009. Authors. John E. Stone, Jan ...

Jun 30, 2010 · Efficient single-. GPU algorithms are capable of evaluating molecular orbital lattices up to. 186 times faster than a single CPU core (see Table ...

High performance computation and interactive display of molecular orbitals on GPUs and multi-core CPUs · Computer Science, Chemistry. GPGPU-2 · 2009.

This chapter presents several graphics processing unit (GPU) algorithms for evaluating molecular orbitals on three-dimensional lattices, as is commonly used ...