Accelerating configuration interaction calculations for nuclear structure
Proceedings of the 2008 ACM/IEEE conference on Supercomputing
Integration of Ab Initio Nuclear Physics Calculations with Optimization Techniques
ICCS '08 Proceedings of the 8th international conference on Computational Science, Part I
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Many modern scientific applications rely on highly parallel calculations, which scale to 10's of thousands processors. However, most applications do not concentrate on parallelizing input/output operations. In particular, sequential I/O has been identified as a bottleneck for the highly scalable MFDn (Many Fermion Dynamics for nuclear structure) code performing ab initio nuclear structure calculations. In this paper, we develop interfaces and parallel I/O procedures to use a well-known parallel I/O library in MFDn. As a result, we gain efficient input/output of large datasets along with their portability and ease of use in the downstream processing.