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Catch errors in v-rescale and Parrinello-Rahman checkpointing

Pascal Merz requested to merge ptmerz-improve-checkpoint-test-1 into master

This adds additional checks to catch checkpoints missing the v-rescale thermostat integral or the Parrinello-Rahman box velocities. This also make the number of steps used in the exact continuation tests explicit, which will be useful in further investigations of #3518 (closed).

In partial fulfillment of #3518 (closed)

Edited by Pascal Merz

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