Mercurial > repos > muon-spectroscopy-computational-project > muspinsim_config
diff test-data/muspinsim_gen_template.in @ 4:e1e338f56656 draft default tip
planemo upload for repository https://github.com/muon-spectroscopy-computational-project/muon-galaxy-tools/main/muspinsim_config commit 70a4d37ecdf5d586703cfc509922311e95d3205c
author | muon-spectroscopy-computational-project |
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date | Tue, 18 Jul 2023 13:26:20 +0000 |
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--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/test-data/muspinsim_gen_template.in Tue Jul 18 13:26:20 2023 +0000 @@ -0,0 +1,106 @@ +spins + mu V V V V V V V V +quadrupolar 2 + -0.008877 2.2e-05 -0.011811 + 2.2e-05 -0.030585 5e-06 + -0.011811 5e-06 0.039462 +dipolar 1 2 + 1.2410539563139198 1.7614965359999998e-05 -1.2417021305964 +dipolar 2 3 + 2.3114439642674407 4.25447999999999e-08 4.7979785243555995 +dipolar 2 4 + 2.3114439642674407 4.25447999999999e-08 -9.3836214756444 +dipolar 2 5 + -11.87015603573256 4.25447999999999e-08 4.7979785243555995 +dipolar 2 6 + 0.0 0.0 14.1816 +dipolar 2 7 + -14.1816 0.0 0.0 +dipolar 2 8 + 0.0 -14.1816 0.0 +dipolar 2 9 + 0.0 14.1816 0.0 +quadrupolar 3 + 0.221597 -2e-06 -0.009013 + -2e-06 -0.109627 -9e-06 + -0.009013 -9e-06 -0.11197 +dipolar 1 3 + 3.5524979205813603 1.7657510159999996e-05 3.5562763937592 +dipolar 3 4 + 0.0 0.0 -14.1816 +dipolar 3 5 + -14.1816 0.0 0.0 +dipolar 3 6 + -2.3114439642674407 -4.25447999999999e-08 9.3836214756444 +dipolar 3 7 + -16.49304396426744 -4.25447999999999e-08 -4.7979785243555995 +dipolar 3 8 + -2.3114439642674407 -14.1816000425448 -4.7979785243555995 +dipolar 3 9 + -2.3114439642674407 14.1815999574552 -4.7979785243555995 +quadrupolar 4 + 0.221597 -2e-06 -0.009013 + -2e-06 -0.109627 -9e-06 + -0.009013 -9e-06 -0.11197 +dipolar 1 4 + 3.5524979205813603 1.7657510159999996e-05 -10.6253236062408 +dipolar 4 5 + -14.1816 0.0 14.1816 +dipolar 4 6 + -2.3114439642674407 -4.25447999999999e-08 23.5652214756444 +dipolar 4 7 + -16.49304396426744 -4.25447999999999e-08 9.3836214756444 +dipolar 4 8 + -2.3114439642674407 -14.1816000425448 9.3836214756444 +dipolar 4 9 + -2.3114439642674407 14.1815999574552 9.3836214756444 +quadrupolar 5 + 0.221597 -2e-06 -0.009013 + -2e-06 -0.109627 -9e-06 + -0.009013 -9e-06 -0.11197 +dipolar 1 5 + -10.62910207941864 1.7657510159999996e-05 3.5562763937592 +dipolar 5 6 + 11.87015603573256 -4.25447999999999e-08 9.3836214756444 +dipolar 5 7 + -2.31144396426744 -4.25447999999999e-08 -4.7979785243555995 +dipolar 5 8 + 11.87015603573256 -14.1816000425448 -4.7979785243555995 +dipolar 5 9 + 11.87015603573256 14.1815999574552 -4.7979785243555995 +quadrupolar 6 + -0.008877 2.2e-05 -0.011811 + 2.2e-05 -0.030585 5e-06 + -0.011811 5e-06 0.039462 +dipolar 1 6 + 1.2410539563139198 1.7614965359999998e-05 12.9398978694036 +dipolar 6 7 + -14.1816 0.0 -14.1816 +dipolar 6 8 + 0.0 -14.1816 -14.1816 +dipolar 6 9 + 0.0 14.1816 -14.1816 +quadrupolar 7 + -0.008877 2.2e-05 -0.011811 + 2.2e-05 -0.030585 5e-06 + -0.011811 5e-06 0.039462 +dipolar 1 7 + -12.94054604368608 1.7614965359999998e-05 -1.2417021305964 +dipolar 7 8 + 14.1816 -14.1816 0.0 +dipolar 7 9 + 14.1816 14.1816 0.0 +quadrupolar 8 + -0.008877 2.2e-05 -0.011811 + 2.2e-05 -0.030585 5e-06 + -0.011811 5e-06 0.039462 +dipolar 1 8 + 1.2410539563139198 -14.18158238503464 -1.2417021305964 +dipolar 8 9 + 0.0 28.3632 0.0 +quadrupolar 9 + -0.008877 2.2e-05 -0.011811 + 2.2e-05 -0.030585 5e-06 + -0.011811 5e-06 0.039462 +dipolar 1 9 + 1.2410539563139198 14.18161761496536 -1.2417021305964