{ "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" [ [ 2.700129 2.133533 1.415237 ] [ 2.985807 2.812498 3.555959 ] [ 1.950344 4.41901 2.566342 ] [ 5.113997 2.527784 1.58139 ] [ 5.483026 3.06067 3.469124 ] [ 3.944653 4.730231 1.719663 ] [ 3.598129 4.831394 3.870985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700129e-10 2.133533e-10 1.415237e-10 ] [ 2.985807e-10 2.812498e-10 3.555959e-10 ] [ 1.950344e-10 4.41901e-10 2.566342e-10 ] [ 5.113997e-10 2.527784e-10 1.58139e-10 ] [ 5.483026e-10 3.06067e-10 3.469124e-10 ] [ 3.944653e-10 4.730231e-10 1.719663e-10 ] [ 3.598129e-10 4.831394000000001e-10 3.870985e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4832827 -3.431732 -4.1705136 ] [ -2.5487242 -13.3919596 8.7787403 ] [ -14.6158074 4.1157974 -4.7857338 ] [ 1.7969195 -3.1849471 -7.1681573 ] [ 4.7379762 0.1397089 6.4517627 ] [ 6.3905191 5.9556501 -10.9743914 ] [ 5.7223994 9.7974823 11.8682931 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.3764808639771e-09 -5.498240779251225e-09 -6.681899386648442e-09 ] [ -4.083506326107183e-09 -2.145628457781812e-08 1.406509246873478e-08 ] [ -2.341710491039563e-08 6.594234370229425e-09 -7.667590807732344e-09 ] [ 2.878982412359626e-09 -5.10284778210476e-09 -1.148465404027685e-08 ] [ 7.591074697546826e-09 2.238383332976851e-10 1.033686336088948e-08 ] [ 1.023874029679586e-08 9.542003351885183e-09 -1.758291332858858e-08 ] [ 9.168294533559948e-09 1.569729708376181e-08 1.901510173362196e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.652029 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.706643182788361e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7472722 2.0090449 1.5896524 ] [ 2.8217287 2.4950057 4.0410996 ] [ 1.910839 4.2685742 2.2576776 ] [ 5.0064141 2.8456204 1.2679817 ] [ 5.2697683 2.8568168 3.6840833 ] [ 4.1166902 5.1018191 1.4262038 ] [ 3.9033724 4.9382389 3.9120015 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7472722e-10 2.0090449e-10 1.5896524e-10 ] [ 2.8217287e-10 2.4950057e-10 4.0410996e-10 ] [ 1.910839e-10 4.2685742e-10 2.2576776e-10 ] [ 5.0064141e-10 2.8456204e-10 1.2679817e-10 ] [ 5.2697683e-10 2.8568168e-10 3.6840833e-10 ] [ 4.1166902e-10 5.1018191e-10 1.4262038e-10 ] [ 3.9033724e-10 4.9382389e-10 3.912001500000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.05e-05 -4.86e-05 -7.9e-06 ] [ -3.43e-05 1.84e-05 4.14e-05 ] [ -1.53e-05 -1.2e-05 -3.43e-05 ] [ -6.87e-05 8.47e-05 1.9e-06 ] [ 2.64e-05 -3.73e-05 -5.4e-06 ] [ 3.89e-05 -1.37e-05 7.9e-06 ] [ 2.25e-05 8.4e-06 -3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.88663869344e-14 -7.786578377088e-14 -1.265719530432e-14 ] [ -5.495465809344e-14 2.948004982272e-14 6.633011210111999e-14 ] [ -2.451330229824e-14 -1.92261194496e-14 -5.495465809344e-14 ] [ -1.1006953384896e-13 1.3570435978176e-13 3.04413557952e-15 ] [ 4.229746278912e-14 -5.976118795584e-14 -8.65175375232e-15 ] [ 6.232467054911999e-14 -2.194981970496e-14 1.265719530432e-14 ] [ 3.604897396800001e-14 1.345828361472e-14 -5.76783583488e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }