{ "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" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8015083 -4.6312594 -2.0700941 ] [ -4.1306724 1.3293716 3.7914695 ] [ -0.7306831 4.1445693 -3.6882685 ] [ 2.3193941 -0.4167128 -1.6975593 ] [ 2.9738694 -3.1901942 2.525218 ] [ 0.0132896 -0.318176 -0.7332408 ] [ 0.3563106 3.0824015 1.8724751 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.284157859637153e-09 -7.420095535540236e-09 -3.316656369876017e-09 ] [ -6.618066747463826e-09 2.129888097875489e-09 6.074603791376266e-09 ] [ -1.170683380033669e-09 6.640332035745422e-09 -5.909257561933084e-09 ] [ 3.716079001441457e-09 -6.676475057481063e-10 -2.719789822881613e-09 ] [ 4.764664025992523e-09 -5.11125456305176e-09 4.045845242023335e-09 ] [ 2.129228641978368e-11 -5.097741484996608e-10 -1.174781267176689e-09 ] [ 5.708725130632204e-10 4.938551619218851e-09 3.000035828250142e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.270739 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.767077424973877e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7244939 1.5239442 2.3100168 ] [ 1.7858036 3.1157171 4.244154 ] [ 2.0702844 3.8997661 1.8870992 ] [ 5.0734761 2.3786935 2.2546444 ] [ 4.1581014 1.914185 4.5344829 ] [ 4.3253779 4.6898622 2.3313189 ] [ 3.8851528 4.393779 4.7031448 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7244939e-10 1.5239442e-10 2.3100168e-10 ] [ 1.7858036e-10 3.1157171e-10 4.244154e-10 ] [ 2.0702844e-10 3.8997661e-10 1.8870992e-10 ] [ 5.0734761e-10 2.3786935e-10 2.2546444e-10 ] [ 4.1581014e-10 1.914185e-10 4.534482900000001e-10 ] [ 4.325377900000001e-10 4.689862200000001e-10 2.3313189e-10 ] [ 3.8851528e-10 4.393779e-10 4.7031448e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.01e-05 3.62e-05 -2.8e-06 ] [ 1.63e-05 1.41e-05 -1.87e-05 ] [ 1.39e-05 -3.4e-05 2.84e-05 ] [ -2.19e-05 -9.7e-06 -1.17e-05 ] [ 4.5e-06 -2.58e-05 1.5e-05 ] [ 4.4e-06 1.37e-05 -2.14e-05 ] [ -2.73e-05 5.4e-06 1.12e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.618198387008e-14 5.799879367296e-14 -4.48609453824e-15 ] [ 2.611547891904e-14 2.259069035328e-14 -2.996070280896e-14 ] [ 2.227025502912e-14 -5.44740051072e-14 4.550181603071999e-14 ] [ -3.508766799552e-14 -1.554111322176e-14 -1.874546646336e-14 ] [ 7.2097947936e-15 -4.133615681664e-14 2.4032649312e-14 ] [ 7.04957713152e-15 2.194981970496e-14 -3.428657968511999e-14 ] [ -4.373942174784e-14 8.65175375232e-15 1.794437815296e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }