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ensure proper initial conditions in helium_worm code (fixes bug with multiple helium environments with worm propagation)
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@ -94,6 +94,9 @@ CONTAINS
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helium%saveiperm(:) = helium%iperm(:)
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helium%savepermutation(:) = helium%permutation(:)
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END IF
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!make sure work array is in sync with pos
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! (helium_print_coordinates for example messes with that...)
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helium%work = helium%pos
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nMC = helium%iter_rot
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ncycle = 0
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