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2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-0.32367240320570306 free_energy=-0.32367240320570306 dipole="-1.7464552343621648e-15 -2.2894646283256654e-06 -4.5749178514600326e-06" magmom=2.0534977727649686e-16 pbc="T T T"
Li 3.28600000 6.57200000 6.57200000 0.00000000 0.00000000 -0.00000000 -0.00000001 -0.00000004
Li 9.85800000 6.57200000 6.57200000 0.00000000 0.00000000 0.00000000 -0.00000001 -0.00000004
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-0.32781048269398894 free_energy=-0.32781048269398894 dipole="1.6565495314566677e-15 -2.31961387411356e-06 -4.634907615878336e-06" magmom=1.2636314995957428e-16 pbc="T T T"
Li 3.39091667 6.57200000 6.57200000 0.00000000 0.00000000 0.03954043 0.00000000 0.00000002
Li 9.75308333 6.57200000 6.57200000 0.00000000 0.00000000 -0.03954043 0.00000000 0.00000002
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-0.3402418031944459 free_energy=-0.3402418031944459 dipole="1.719465713603353e-16 -2.2808192156728963e-06 -4.556996891472164e-06" magmom=-3.17883433137975e-16 pbc="T T T"
Li 3.49583333 6.57200000 6.57200000 0.00000000 0.00000000 0.07887298 0.00000002 0.00000004
Li 9.64816667 6.57200000 6.57200000 0.00000000 0.00000000 -0.07887298 0.00000002 0.00000004
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-0.36102301994889646 free_energy=-0.36102301994889646 dipole="8.865783809865694e-16 -2.293899233921584e-06 -4.583784325971606e-06" magmom=-3.6661809135692465e-16 pbc="T T T"
Li 3.60075000 6.57200000 6.57200000 0.00000000 -0.00000000 0.11924429 -0.00000002 -0.00000002
Li 9.54325000 6.57200000 6.57200000 0.00000000 -0.00000000 -0.11924429 -0.00000002 -0.00000002
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-0.3902400141145633 free_energy=-0.3902400141145633 dipole="3.226072373915796e-15 -2.2696505427962665e-06 -4.536905240538335e-06" magmom=4.0521882677983953e-16 pbc="T T T"
Li 3.70566667 6.57200000 6.57200000 0.00000000 0.00000000 0.15954770 -0.00000002 -0.00000003
Li 9.43833333 6.57200000 6.57200000 0.00000000 0.00000000 -0.15954770 -0.00000002 -0.00000003
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-0.4280032588450426 free_energy=-0.4280032588450426 dipole="2.451207917476477e-15 -2.2418616870067023e-06 -4.480635855232374e-06" magmom=1.5181840367037944e-16 pbc="T T T"
Li 3.81058333 6.57200000 6.57200000 0.00000000 -0.00000000 0.20039236 0.00000001 0.00000002
Li 9.33341667 6.57200000 6.57200000 0.00000000 -0.00000000 -0.20039236 0.00000001 0.00000002
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-0.4744279380504106 free_energy=-0.4744279380504106 dipole="2.8616193342784067e-15 -2.238897036827717e-06 -4.473590315408156e-06" magmom=2.5689948233532853e-16 pbc="T T T"
Li 3.91550000 6.57200000 6.57200000 0.00000000 0.00000000 0.24142547 0.00000000 -0.00000000
Li 9.22850000 6.57200000 6.57200000 0.00000000 0.00000000 -0.24142547 0.00000000 -0.00000000
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-0.5296083498948483 free_energy=-0.5296083498948483 dipole="5.865809511191729e-15 -2.16172418322767e-06 -4.320045595934671e-06" magmom=3.940279590992743e-16 pbc="T T T"
Li 4.02041667 6.57200000 6.57200000 0.00000000 0.00000000 0.28054713 -0.00000001 -0.00000001
Li 9.12358333 6.57200000 6.57200000 0.00000000 0.00000000 -0.28054713 -0.00000001 -0.00000001
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-0.5936058235470442 free_energy=-0.5936058235470442 dipole="8.381633948220826e-15 -2.137125808901458e-06 -4.2699622481065e-06" magmom=2.7327958313944276e-16 pbc="T T T"
Li 4.12533333 6.57200000 6.57200000 0.00000000 0.00000000 0.32159282 -0.00000002 -0.00000002
Li 9.01866667 6.57200000 6.57200000 0.00000000 0.00000000 -0.32159282 -0.00000002 -0.00000002
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-0.6663521101287647 free_energy=-0.6663521101287647 dipole="7.837414230467103e-15 -2.0561361181858103e-06 -4.107473000169909e-06" magmom=4.960511859017244e-17 pbc="T T T"
Li 4.23025000 6.57200000 6.57200000 0.00000000 0.00000000 0.36458230 -0.00000003 -0.00000006
Li 8.91375000 6.57200000 6.57200000 0.00000000 0.00000000 -0.36458230 -0.00000003 -0.00000006
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-0.7475862825748789 free_energy=-0.7475862825748789 dipole="1.2619140306455835e-14 -2.0145559835864838e-06 -4.025609551224419e-06" magmom=-2.3033632480801495e-16 pbc="T T T"
Li 4.33516667 6.57200000 6.57200000 0.00000000 -0.00000000 0.40380287 -0.00000000 0.00000001
Li 8.80883333 6.57200000 6.57200000 0.00000000 -0.00000000 -0.40380287 -0.00000000 0.00000001
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-0.8367602413713815 free_energy=-0.8367602413713815 dipole="5.12762803410696e-15 -1.953016580167462e-06 -3.903975273267099e-06" magmom=-8.892670638600509e-17 pbc="T T T"
Li 4.44008333 6.57200000 6.57200000 0.00000000 0.00000000 0.44241849 -0.00000002 -0.00000004
Li 8.70391667 6.57200000 6.57200000 0.00000000 0.00000000 -0.44241849 -0.00000002 -0.00000004
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-0.9328220289966356 free_energy=-0.9328220289966356 dipole="7.087591615026137e-15 -1.8437705963693956e-06 -3.684321396438568e-06" magmom=-9.351709529769093e-17 pbc="T T T"
Li 4.54500000 6.57200000 6.57200000 0.00000000 -0.00000000 0.47190235 -0.00000001 -0.00000003
Li 8.59900000 6.57200000 6.57200000 0.00000000 -0.00000000 -0.47190235 -0.00000001 -0.00000003
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-1.0340302475610486 free_energy=-1.0340302475610486 dipole="5.757041527805177e-15 -1.7607164952575005e-06 -3.5176838166804224e-06" magmom=-3.2491759453668022e-18 pbc="T T T"
Li 4.64991667 6.57200000 6.57200000 0.00000000 0.00000000 0.49033672 -0.00000002 -0.00000005
Li 8.49408333 6.57200000 6.57200000 0.00000000 0.00000000 -0.49033672 -0.00000002 -0.00000005
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-1.1375599216503347 free_energy=-1.1375599216503347 dipole="8.35306390436821e-16 -1.6647019454679788e-06 -3.3278838395678474e-06" magmom=-6.159356187873316e-16 pbc="T T T"
Li 4.75483333 6.57200000 6.57200000 0.00000000 -0.00000000 0.49126023 -0.00000003 -0.00000007
Li 8.38916667 6.57200000 6.57200000 0.00000000 -0.00000000 -0.49126023 -0.00000003 -0.00000007
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-1.239039312537771 free_energy=-1.239039312537771 dipole="1.4183657031848297e-15 -1.5835538901785626e-06 -3.1657900274711076e-06" magmom=2.3093947131636895e-16 pbc="T T T"
Li 4.85975000 6.57200000 6.57200000 0.00000000 0.00000000 0.46697961 -0.00000001 -0.00000003
Li 8.28425000 6.57200000 6.57200000 0.00000000 0.00000000 -0.46697961 -0.00000001 -0.00000003
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-1.3318253037563534 free_energy=-1.3318253037563534 dipole="-1.6887525197647548e-15 -1.5091630881348786e-06 -3.016638222271172e-06" magmom=-7.535270943164158e-17 pbc="T T T"
Li 4.96466667 6.57200000 6.57200000 0.00000000 -0.00000000 0.40690033 -0.00000001 -0.00000003
Li 8.17933333 6.57200000 6.57200000 0.00000000 -0.00000000 -0.40690033 -0.00000001 -0.00000003
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-1.4059752891203132 free_energy=-1.4059752891203132 dipole="-2.154344051829748e-15 -1.4030820686348543e-06 -2.8050564067321788e-06" magmom=2.497425581825816e-16 pbc="T T T"
Li 5.06958333 6.57200000 6.57200000 0.00000000 0.00000000 0.28692814 -0.00000002 -0.00000004
Li 8.07441667 6.57200000 6.57200000 0.00000000 0.00000000 -0.28692814 -0.00000002 -0.00000004
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-1.4467961224712185 free_energy=-1.4467961224712185 dipole="-1.4940770710092692e-15 -1.3055894817532451e-06 -2.6088779929761126e-06" magmom=2.4314675224677206e-16 pbc="T T T"
Li 5.17450000 6.57200000 6.57200000 0.00000000 0.00000000 0.08326671 -0.00000001 -0.00000001
Li 7.96950000 6.57200000 6.57200000 0.00000000 0.00000000 -0.08326671 -0.00000001 -0.00000001
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-1.4327987213394833 free_energy=-1.4327987213394833 dipole="-2.72813294761857e-15 -1.1912329875285533e-06 -2.3807521466611765e-06" magmom=1.9358760185437113e-16 pbc="T T T"
Li 5.27941667 6.57200000 6.57200000 0.00000000 0.00000000 -0.24299757 -0.00000001 -0.00000001
Li 7.86458333 6.57200000 6.57200000 0.00000000 0.00000000 0.24299757 -0.00000001 -0.00000001
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-1.3330259651506418 free_energy=-1.3330259651506418 dipole="-3.0411569065299264e-15 -1.0798124723991367e-06 -2.158925459498135e-06" magmom=2.3969778879924684e-16 pbc="T T T"
Li 5.38433333 6.57200000 6.57200000 0.00000000 0.00000000 -0.74413473 0.00000002 0.00000003
Li 7.75966667 6.57200000 6.57200000 0.00000000 0.00000000 0.74413473 0.00000002 0.00000003
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-1.1040845169291766 free_energy=-1.1040845169291766 dipole="-4.725316731953698e-16 -9.268294660927581e-07 -1.8531628274900135e-06" magmom=-7.005936963114594e-17 pbc="T T T"
Li 5.48925000 6.57200000 6.57200000 0.00000000 0.00000000 -1.48396845 -0.00000002 -0.00000005
Li 7.65475000 6.57200000 6.57200000 0.00000000 0.00000000 1.48396845 -0.00000002 -0.00000005
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-0.6887430177179096 free_energy=-0.6887430177179096 dipole="2.412207816789624e-15 -8.501419268446813e-07 -1.6976626882578491e-06" magmom=-1.5584982303438093e-16 pbc="T T T"
Li 5.59416667 6.57200000 6.57200000 0.00000000 0.00000000 -2.52818805 -0.00000001 -0.00000003
Li 7.54983333 6.57200000 6.57200000 0.00000000 0.00000000 2.52818805 -0.00000001 -0.00000003
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=-0.020429802869862998 free_energy=-0.020429802869862998 dipole="3.8770939471883555e-15 -7.388195234496302e-07 -1.478751574069518e-06" magmom=-3.2497742075242365e-16 pbc="T T T"
Li 5.69908333 6.57200000 6.57200000 0.00000000 -0.00000000 -3.89072207 0.00000000 0.00000001
Li 7.44491667 6.57200000 6.57200000 0.00000000 -0.00000000 3.89072207 0.00000000 0.00000001
2
Lattice="13.144000000000002 0.0 0.0 0.0 13.145000000000001 0.0 0.0 0.0 13.146000000000003" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1:forces:R:3 energy=0.9613541211295941 free_energy=0.9613541211295941 dipole="3.0339890805629027e-16 -6.250967499572623e-07 -1.248555117224722e-06" magmom=1.1585292656071374e-16 pbc="T T T"
Li 5.80400000 6.57200000 6.57200000 0.00000000 0.00000000 -5.50365725 -0.00000000 -0.00000001
Li 7.34000000 6.57200000 6.57200000 0.00000000 0.00000000 5.50365725 -0.00000000 -0.00000001
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