{ "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" [ [ 2.743488 1.903222 1.191758 ] [ 2.092285 1.109675 3.649357 ] [ 1.94045 3.241003 2.726585 ] [ 4.050079 0.1031898 2.277213 ] [ 5.000478 2.032764 2.106801 ] [ 4.158728 1.007331 4.48257 ] [ 3.981083 3.39009 3.613579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743488e-10 1.903222e-10 1.191758e-10 ] [ 2.092285e-10 1.109675e-10 3.649357e-10 ] [ 1.94045e-10 3.241003e-10 2.726585e-10 ] [ 4.050079e-10 1.031898e-11 2.277213e-10 ] [ 5.000478000000001e-10 2.032764e-10 2.106801e-10 ] [ 4.158728e-10 1.007331e-10 4.48257e-10 ] [ 3.981083e-10 3.39009e-10 3.613579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.3565623 0.0623665 -27.3950298 ] [ -23.1126593 -13.7591008 14.8203207 ] [ -8.307967 8.9583576 1.0456893 ] [ 6.3504419 -18.646061 -6.6297669 ] [ 19.1848268 8.3263866 -12.1224209 ] [ 2.9881121 -5.6735443 19.3781697 ] [ 12.2538078 20.7315954 10.9030379 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.499086536811868e-08 9.99221482211232e-11 -4.38916762716793e-08 ] [ -3.703056237497569e-08 -2.204450962499058e-08 2.374477133829829e-08 ] [ -1.331083049377791e-08 1.4352871107486e-08 1.675378949080718e-09 ] [ 1.017452954392873e-08 -2.987428300421067e-08 -1.062205752853369e-08 ] [ 3.073748097305728e-08 1.33403419462624e-08 -1.942225935347729e-08 ] [ 4.787483346949592e-09 -9.090020034533102e-09 3.104725044723495e-08 ] [ 1.963276437293668e-08 3.321567746176483e-08 1.746859241907633e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 6.0363472 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.671294358871543e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.6806216 2.4253223 0.6650536 ] [ 1.5029724 1.1240615 4.1139974 ] [ 1.8688542 3.1415333 2.829101 ] [ 4.8820089 -0.0635255 2.648701 ] [ 4.9215483 2.0686381 1.5053168 ] [ 3.8576351 0.8930552 4.6211689 ] [ 4.2529504 3.1981899 3.6645243 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6806216e-10 2.4253223e-10 6.650536000000001e-11 ] [ 1.5029724e-10 1.1240615e-10 4.1139974e-10 ] [ 1.8688542e-10 3.1415333e-10 2.829101e-10 ] [ 4.8820089e-10 -6.35255e-12 2.648701e-10 ] [ 4.9215483e-10 2.0686381e-10 1.5053168e-10 ] [ 3.8576351e-10 8.930552000000001e-11 4.6211689e-10 ] [ 4.252950399999999e-10 3.1981899e-10 3.6645243e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.04e-05 -6.9e-06 -1.37e-05 ] [ 1.43e-05 7e-06 -4.4e-06 ] [ -3.27e-05 1.52e-05 -2.61e-05 ] [ -1e-07 -1.15e-05 2.6e-06 ] [ 7.9e-06 1.42e-05 -7.7e-06 ] [ 7e-06 -1.46e-05 1.88e-05 ] [ 2.4e-05 -3.4e-06 3.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.268440306432e-14 -1.105501868352e-14 -2.194981970496e-14 ] [ 2.291112567744e-14 1.12152363456e-14 -7.04957713152e-15 ] [ -5.239117550016001e-14 2.435308463616e-14 -4.181680980288e-14 ] [ -1.6021766208e-16 -1.84250311392e-14 4.16565921408e-15 ] [ 1.265719530432e-14 2.275090801536e-14 -1.233675998016e-14 ] [ 1.12152363456e-14 -2.339177866368e-14 3.012092047104e-14 ] [ 3.84522388992e-14 -5.44740051072e-15 4.88663869344e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.457688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.797029956682071e-18 } }