This work can be successfully finished on Ubuntu 18.04 using NWCHEM6.8 with four threads
QMD Run Information
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Time elapsed (fs) : ...
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Dipole (a.u.) : 20000 ...
and on macOS Mojave it also can finish smoothly using three cores, although slower, perhaps with the identical results because I have only checked the last several steps of the very large number of the data produced
QMD Run Information
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Time elapsed (fs) : ...
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Dipole (a.u.) : 20000 ...
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