`XspectraCrystalWorkChain`: Fix Input Bugs #2557

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Run time

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Job	Run time
integration (3.10)	2m 25s
tests (3.8)	3m 39s
pre-commit	2m 14s
tests (3.9)	5m 5s
tests (3.10)	5m 25s
tests (3.11)	4m 59s
	23m 47s