20
Lattice="4.934058589594899 -2.848631916279114 0.0 4.934057226246598 2.8486295548906058 0.0 -1.4656948966743986e-16 1.740886431771337e-23 24.66943225493218" Properties=species:S:1:pos:R:3:tags:I:1:initial_magmoms:R:1:forces:R:3:magmoms:R:1 energy=-149.23035009844614 stress="2.150912050786798e-06 -1.4369284390648894e-06 2.815614459421902e-06 -1.4369284390648894e-06 -4.7707272204239366e-06 3.230460886824416e-06 2.815614459421902e-06 3.230460886824416e-06 1.3101421332765805e-05" dipole="-6.608759797124875 0.05761294861090711 7.166306882588975e-06" magmom=0.0 free_energy=-149.25198749605582 pbc="T T F"
Ta      -0.00006980      -0.00018210       9.07454265        0       0.00000000      -0.00020191      -0.00089985       0.00837068       0.00000000
S        1.69773201       0.91872323      10.72444368        0       0.00000000       0.00603837      -0.00403470      -0.00610538       0.00000000
S        1.62752347       0.95912658       7.49233135        0       0.00000000      -0.00262934       0.00189149      -0.00384270       0.00000000
Ta       0.00005257      -0.00018797      15.59491573        1       0.00000000      -0.00026911       0.00040285      -0.00902326       0.00000000
S        4.88102628      -0.91908090      13.94489006        1       0.00000000      -0.00614000       0.00323800       0.00703061       0.00000000
S        4.95118443      -0.95954316      17.17714772        1       0.00000000       0.00264655      -0.00185891       0.00257094       0.00000000
Ta       3.28929677      -0.00021895       9.04689841        0       0.00000000       0.00053595       0.00001458      -0.00474533       0.00000000
S        4.88087937       0.91863119      10.72452412        0       0.00000000      -0.00530665      -0.00308567      -0.00687200       0.00000000
S        4.95107734       0.95919814       7.49228454        0       0.00000000       0.00270526       0.00135913      -0.00257115       0.00000000
Ta       3.28943944      -0.00020000      15.62246258        1       0.00000000      -0.00033415       0.00000833       0.00499043       0.00000000
S        3.28944949       1.83759791      13.94487645        1       0.00000000      -0.00036423      -0.00699168       0.00690894       0.00000000
S        3.28936338       1.91863040      17.17704711        1       0.00000000       0.00055551       0.00299752       0.00377849       0.00000000
Ta       6.57871633      -0.00026627       9.07449803        0       0.00000000      -0.00081421       0.00109260       0.00877854       0.00000000
S        3.28931700      -1.83797555      10.72451523        0       0.00000000       0.00012010       0.00660551      -0.00655873       0.00000000
S        3.28927087      -1.91904993       7.49230761        0       0.00000000       0.00050010      -0.00304125      -0.00332740       0.00000000
Ta       6.57880244      -0.00018680      15.59489059        1       0.00000000      -0.00045708      -0.00002079      -0.00890505       0.00000000
S        1.69782149      -0.91909344      13.94487048        1       0.00000000       0.00613989       0.00380203       0.00712665       0.00000000
S        1.62762310      -0.95956379      17.17706985        1       0.00000000      -0.00222894      -0.00169826       0.00347038       0.00000000
Ta       0.00006549      -0.00023752      12.33472484        2       0.00000000      -0.00048324       0.00039318      -0.00063932       0.00000000
Ta       6.57873152      -0.00018625      12.33474075        2       0.00000000      -0.00001290      -0.00017407      -0.00074795       0.00000000