Abstract: A hybrid quantum mechanical/molecular mechanical (QM/MM) potential energy function with HartreeFock, density functional theory (DFT), and post-HF (RIMP2, MP2, CCSD) capab...
H. Lee Woodcock III, Milan Hodoscek, Andrew T. B. ...
Mixture models form one of the most widely used classes of generative models for describing structured and clustered data. In this paper we develop a new approach for the analysis...
Abstract. Recently, we have proposed a novel method for the compression of time series based on mathematical models that explore dependencies between different time series. This r...
We present the Network File System with Cluster Delegation (NFS-CD), an enhancement to the NFSv4 that reduces server load and increases the scalability of distributed file systems ...
Scientific computing has seen an immense growth in recent years. The Message Passing Interface (MPI) has become the de-facto standard for parallel programming model for distribute...