{ "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" [ [ 0.8526274 -0.4148812 -0.548233 ] [ 0.3885271 0.8888593 0.4910523 ] [ 0.2430407 0.8675154 -0.6564276 ] [ -0.9136299 0.6476995 0.063194 ] [ 0.4404133 -1.1682129 0.4193182 ] [ -0.5497785 -1.5708797 -0.3711597 ] [ -0.4612 0.7498997 0.6022558 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.366059697788171e-09 -6.647129645258808e-10 -8.783661025877219e-10 ] [ 6.224890412957814e-10 1.424109601373596e-09 7.867525211319582e-10 ] [ 3.893941306510038e-10 1.389912903515163e-09 -1.051712962632698e-09 ] [ -1.463796477903756e-09 1.037729004753483e-09 1.01247950208996e-10 ] [ 7.056198985628321e-10 -1.871683411917379e-09 6.718218222509387e-10 ] [ -8.808422665755687e-10 -2.51682675016493e-09 -5.946633988224496e-10 ] [ -7.389238636007999e-10 1.20147177718361e-09 9.64920170450977e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.198838 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.236210627755129e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6327815 1.4123119 2.6132464 ] [ 1.9169375 3.1313469 4.0996514 ] [ 2.4563833 3.642252 1.7927678 ] [ 4.6657251 2.5260555 2.0622021 ] [ 4.1262774 2.0151562 4.3690889 ] [ 4.3750758 4.8432896 2.5401877 ] [ 3.8495095 4.3455348 4.7877166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6327815e-10 1.4123119e-10 2.6132464e-10 ] [ 1.9169375e-10 3.1313469e-10 4.0996514e-10 ] [ 2.4563833e-10 3.642252e-10 1.7927678e-10 ] [ 4.665725100000001e-10 2.5260555e-10 2.0622021e-10 ] [ 4.1262774e-10 2.0151562e-10 4.369088900000001e-10 ] [ 4.3750758e-10 4.8432896e-10 2.5401877e-10 ] [ 3.8495095e-10 4.345534800000001e-10 4.7877166e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.55e-05 7e-06 -4.5e-06 ] [ -1.55e-05 1.61e-05 2.43e-05 ] [ 2e-07 -1.2e-06 -8.1e-06 ] [ -1e-06 9.1e-06 5e-06 ] [ 5.8e-06 -4.8e-06 5e-07 ] [ 4.9e-06 -7.6e-06 -1.57e-05 ] [ -9.8e-06 -1.87e-05 -1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.4833737827e-14 1.1215236438e-14 -7.209794853e-15 ] [ -2.4833737827e-14 2.579504380739999e-14 3.893289220619999e-14 ] [ 3.204353268e-16 -1.9226119608e-15 -1.29776307354e-14 ] [ -1.602176634e-15 1.45798073694e-14 8.010883169999999e-15 ] [ 9.2926244772e-15 -7.690447843199998e-15 8.010883169999999e-16 ] [ 7.850665506599998e-15 -1.21765424184e-14 -2.515417315379999e-14 ] [ -1.57013310132e-14 -2.99607030558e-14 -2.403264951e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.43874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.434864829040116e-18 } }