Perspective review demonstrates the evolution of parallel software across high-performance computing platforms, highlighting key adaptations in quantum chemistry algorithms.
Parallel hardware has become readily available to the computational chemistry research community. This perspective will review the current state of parallel computational chemistry software utilizing high-performance parallel computing platforms. Hardware and software trends and their effect on quantum chemistry methodologies, algorithms, and software development will also be discussed.
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Jong et al. (2010) studied this question.
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