21
Lattice="5.097867102318435 -2.945995813114126 0.0 5.096604925859285 2.9438093640356335 0.0 4.220223588405808e-17 -8.935216477908968e-21 25.556148492420373" Properties=species:S:1:pos:R:3:tags:I:1:initial_magmoms:R:1:forces:R:3:magmoms:R:1 energy=-141.93641822626196 stress="6.393344858138681e-05 -0.00010920243284586629 -4.195544603702666e-05 -0.00010920243284586629 0.0003936226042101288 -3.807472059311832e-05 -4.195544603702666e-05 -3.807472059311832e-05 -0.0003394448911593891" dipole="-0.03418039449393974 0.07226876937090022 -6.927263704178432e-06" magmom=0.0 free_energy=-141.98167293972506 pbc="T T F"
Ta       0.00396795       0.00053927       9.19523975        0       0.00000000       0.00536541       0.00250159      -0.00743521       0.00000000
Se       1.69880862       0.98097758      11.01364948        0       0.00000000       0.00414277       0.00518776       0.00651388       0.00000000
Se       5.09666525      -0.98282816       7.49468619        0       0.00000000      -0.00527888      -0.00360757      -0.00650475       0.00000000
Ta      -0.00154342      -0.00203954      16.36088110        1       0.00000000      -0.00273452      -0.00400259       0.00683768       0.00000000
Se       1.69836866       0.98107278      18.06023510        1       0.00000000       0.00042944       0.00483987       0.00527994       0.00000000
Se       5.09758290      -0.98296687      14.54369707        1       0.00000000      -0.00365508      -0.00482230      -0.00491735       0.00000000
Ta       3.39650231       0.00185983       9.19521193        0       0.00000000      -0.00144890       0.00513674      -0.00736648       0.00000000
Se       5.09685237       0.98044020      11.01279063        0       0.00000000       0.00367450       0.00503570       0.00499562       0.00000000
Se       3.39862185       1.96325505       7.49532226        0       0.00000000      -0.00227999      -0.00211956      -0.00557398       0.00000000
Ta       3.39716632      -0.00032867      16.36034821        1       0.00000000      -0.00218691      -0.00087932       0.00931533       0.00000000
Se       5.09670838       0.97981632      18.06102890        1       0.00000000       0.00386868       0.00313055       0.00615637       0.00000000
Se       3.39733492       1.96236905      14.54297049        1       0.00000000      -0.00281738      -0.00568306      -0.00606527       0.00000000
Ta       6.79442602      -0.00509293       9.19522954        0       0.00000000      -0.00147926      -0.00281209      -0.00689947       0.00000000
Se       3.39838078      -1.96415973      11.01201156        0       0.00000000       0.00384968       0.00474143       0.00449065       0.00000000
Se       1.70003503      -0.98313740       7.49514528        0       0.00000000      -0.00259959      -0.00562641      -0.00579689       0.00000000
Ta       6.79829685      -0.00030758      16.36113081        1       0.00000000       0.00143114      -0.00022617       0.00569252       0.00000000
Se       3.39887038      -1.96346736      18.06159519        1       0.00000000       0.00265742       0.00278397       0.00699894       0.00000000
Se       1.69885738      -0.98223991      14.54300528        1       0.00000000      -0.00279688      -0.00396631      -0.00525512       0.00000000
Ta       3.39754830      -0.00037653      12.77815307        2       0.00000000       0.00050197      -0.00017411      -0.00010711       0.00000000
Ta       6.79617119      -0.00215875      12.77787779        2       0.00000000       0.00027661       0.00068049       0.00025002       0.00000000
Ta      -0.00005620      -0.00030485      12.77804641        2       0.00000000       0.00107989      -0.00011848      -0.00036697       0.00000000