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kilian

2026-08-27 15:15:22 +02:00

parent 05fd838f9f

commit 93f2e72581

3 changed files with 9951 additions and 0 deletions

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Butadien/alt_p_{0,1}/orca_nmr.out

+2309

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Butadien/alt_p_{0,1}/orca_opt.out

+4892

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Butadien/alt_p_{0,1}/orca_sscc.out

+2750

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