{ "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" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.7146266 6.2149721 0.4950364 ] [ 4.8495193 -3.5022292 -2.9158092 ] [ 5.1552649 -3.710462 -2.0081036 ] [ -3.7350027 2.4267208 6.9976935 ] [ -1.3795657 6.2047905 -2.9148399 ] [ 1.0446606 -7.5149749 4.8271867 ] [ -8.649503 -0.1188173 -4.4811639 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.349311272721793e-09 9.957482997544279e-09 7.931357465249972e-10 ] [ 7.769786444578382e-09 -5.611189744923088e-09 -4.671641330953551e-09 ] [ 8.25964489681085e-09 -5.944815468766809e-09 -3.217336640064315e-09 ] [ -5.984134004564876e-09 3.888035330969073e-09 1.121154092522412e-08 ] [ -2.210307911397587e-09 9.941170276061941e-09 -4.67008834115501e-09 ] [ 1.673730789990901e-09 -1.204031709067882e-08 7.734005674976705e-09 ] [ -1.385803148813946e-08 -1.903663002065798e-10 -7.17961603455295e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.773254 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.250854134634009e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.782921 2.7574216 2.2472552 ] [ 2.8180058 4.4949673 3.6440141 ] [ 1.1729265 3.0242622 3.7319392 ] [ 4.6243309 2.7799897 1.0322373 ] [ 3.2096886 2.4421484 4.3919885 ] [ 3.6473303 4.6873053 1.6071472 ] [ 4.703912 3.4658956 3.1299016 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.782921e-10 2.7574216e-10 2.2472552e-10 ] [ 2.8180058e-10 4.4949673e-10 3.6440141e-10 ] [ 1.1729265e-10 3.0242622e-10 3.7319392e-10 ] [ 4.6243309e-10 2.7799897e-10 1.0322373e-10 ] [ 3.2096886e-10 2.4421484e-10 4.3919885e-10 ] [ 3.6473303e-10 4.687305300000001e-10 1.6071472e-10 ] [ 4.703912e-10 3.4658956e-10 3.1299016e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0001849 -8.1e-05 0.0001496 ] [ -6.43e-05 0.00012 2.11e-05 ] [ 9.08e-05 -2.65e-05 -3.94e-05 ] [ 5.18e-05 -9.29e-05 5.4e-06 ] [ 6.57e-05 -7.58e-05 -0.0001344 ] [ 0.0001253 6.49e-05 4.15e-05 ] [ -8.43e-05 9.13e-05 -4.39e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.9624245718592e-13 -1.297763062848e-13 2.3968562247168e-13 ] [ -1.0301995671744e-13 1.92261194496e-13 3.380592669888e-14 ] [ 1.4547763716864e-13 -4.24576804512e-14 -6.312575885952001e-14 ] [ 8.299274895744e-14 -1.4884220807232e-13 8.65175375232e-15 ] [ 1.0526300398656e-13 -1.2144498785664e-13 -2.1533253783552e-13 ] [ 2.0075273058624e-13 1.0398126268992e-13 6.64903297632e-14 ] [ -1.3506348913344e-13 1.4627872547904e-13 -7.033555365312e-14 ] ] } "relaxed-potential-energy" { "source-value" -49.241665 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.889384443226563e-18 } }