{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2214552 -0.5527588 -1.850672 ] [ 0.8598675 -0.6243359 -1.2092155 ] [ 3.2587304 0.3939021 -1.4786886 ] [ 1.1651812 3.0066905 4.8603587 ] [ -5.3931191 -0.7768547 -0.2895179 ] [ -2.1108755 -1.0356651 2.1921243 ] [ 0.9987603 -0.410978 -2.224389 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.956986964794588e-09 -8.856172263014631e-10 -2.965103411169178e-09 ] [ 1.377659605485744e-09 -1.000296382506127e-09 -1.937376803608982e-09 ] [ 5.221061660370233e-09 6.311007355040237e-10 -2.369120304363483e-09 ] [ 1.866826077635689e-09 4.817249225081462e-09 7.78715307784188e-09 ] [ -8.640729335209938e-09 -1.244658438098598e-09 -4.638588106831123e-10 ] [ -3.381995375519511e-09 -1.659318410198494e-09 3.512170303347566e-09 ] [ 1.600190402443194e-09 -6.584593432631424e-10 -3.563864051364691e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.25416 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.885944810914252e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2800458 2.1732301 4.3625417 ] [ 2.7089824 3.9602752 2.7094334 ] [ 5.0932185 0.799282 1.9331802 ] [ 4.6278347 2.7093387 3.5647683 ] [ 2.8695886 1.6378279 2.0827403 ] [ 3.8853371 0.4164179 3.976598 ] [ 3.2237209 4.2518551 5.039916 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2800458e-10 2.1732301e-10 4.3625417e-10 ] [ 2.7089824e-10 3.9602752e-10 2.7094334e-10 ] [ 5.0932185e-10 7.992820000000001e-11 1.9331802e-10 ] [ 4.6278347e-10 2.7093387e-10 3.5647683e-10 ] [ 2.8695886e-10 1.6378279e-10 2.0827403e-10 ] [ 3.8853371e-10 4.164179e-11 3.976598e-10 ] [ 3.2237209e-10 4.2518551e-10 5.039916e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.71e-05 -1.41e-05 3.38e-05 ] [ 2.08e-05 -2.51e-05 -1.76e-05 ] [ -3.6e-06 5.18e-05 -4.7e-06 ] [ 1.14e-05 4.58e-05 -3.37e-05 ] [ 1.28e-05 -1.85e-05 -4.59e-05 ] [ -3.91e-05 -4.92e-05 4.59e-05 ] [ 2.46e-05 9.4e-06 2.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.341898642368e-14 -2.259069035328e-14 5.415356978304e-14 ] [ 3.332527371264e-14 -4.021463318208e-14 -2.819830852608e-14 ] [ -5.76783583488e-15 8.299274895744e-14 -7.53023011776e-15 ] [ 1.826481347712e-14 7.337968923264e-14 -5.399335212096e-14 ] [ 2.050786074624e-14 -2.96402674848e-14 -7.353990689472e-14 ] [ -6.264510587328001e-14 -7.882708974336e-14 7.353990689472e-14 ] [ 3.941354487168e-14 1.506046023552e-14 3.540810331968e-14 ] ] } "relaxed-potential-energy" { "source-value" -28.889965 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.628682649873028e-18 } }