{ "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" [ [ 2.327038 2.33879 1.333944 ] [ 3.095823 1.457233 3.921802 ] [ 1.16952 4.791902 2.053879 ] [ 1.997895 3.950607 4.032131 ] [ 4.742513 1.791132 2.167365 ] [ 3.563011 4.139404 2.001972 ] [ 4.473125 3.165685 4.251983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.327038e-10 2.33879e-10 1.333944e-10 ] [ 3.095823e-10 1.457233e-10 3.921802e-10 ] [ 1.16952e-10 4.791902e-10 2.053879e-10 ] [ 1.997895e-10 3.950607e-10 4.032131e-10 ] [ 4.742513e-10 1.791132e-10 2.167365e-10 ] [ 3.563011e-10 4.139404e-10 2.001972e-10 ] [ 4.473124999999999e-10 3.165685e-10 4.251983e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.651118 -1.813428 -2.4542856 ] [ -1.3310145 -3.6538353 2.2964247 ] [ -1.4830052 1.2841843 -1.1048541 ] [ -1.2857893 0.9168387 3.3260484 ] [ 1.2842825 -0.9569644 -1.3196469 ] [ 1.6808636 3.1773682 -2.4796197 ] [ 1.7857809 1.0458364 1.7359332 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.043206036982054e-09 -2.905431945104102e-09 -3.932199009086101e-09 ] [ -2.132520313845802e-09 -5.854089493913754e-09 3.679277965767654e-09 ] [ -2.376036259964829e-09 2.057490062258414e-09 -1.770171408415026e-09 ] [ -2.060061555734797e-09 1.468937530184665e-09 5.328916986129247e-09 ] [ 2.057647396002576e-09 -1.5332259886179e-09 -2.114307410891195e-09 ] [ 2.693040362673723e-09 5.090705045713379e-09 -3.97278871181511e-09 ] [ 2.861136407851183e-09 1.675614629261637e-09 2.781271588310531e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.94179 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.554156323170323e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1866208 1.7722671 1.5582983 ] [ 1.9007888 1.2643396 3.9235536 ] [ 1.9281107 4.168164 2.0742543 ] [ 2.0249178 3.6331685 4.477957 ] [ 4.5653418 2.1416059 1.1849551 ] [ 4.3806993 4.4087704 2.056738 ] [ 4.3824458 4.2464375 4.4873198 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1866208e-10 1.7722671e-10 1.5582983e-10 ] [ 1.9007888e-10 1.2643396e-10 3.9235536e-10 ] [ 1.9281107e-10 4.168164e-10 2.0742543e-10 ] [ 2.0249178e-10 3.6331685e-10 4.477957e-10 ] [ 4.5653418e-10 2.1416059e-10 1.1849551e-10 ] [ 4.3806993e-10 4.4087704e-10 2.056738e-10 ] [ 4.3824458e-10 4.2464375e-10 4.4873198e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8e-06 -7.3e-06 -1e-06 ] [ 5.6e-06 1.84e-05 -1.38e-05 ] [ -2.73e-05 1.41e-05 -5.9e-06 ] [ -1.9e-06 -3.7e-06 -1.16e-05 ] [ 2.68e-05 1e-06 6.6e-06 ] [ -3.36e-05 -2.26e-05 -5.36e-05 ] [ 3.85e-05 0.0 7.93e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.28174129664e-14 -1.169588933184e-14 -1.6021766208e-15 ] [ 8.972189076479999e-15 2.948004982272e-14 -2.211003736704e-14 ] [ -4.373942174784e-14 2.259069035328e-14 -9.45284206272e-15 ] [ -3.04413557952e-15 -5.928053496960001e-15 -1.858524880128e-14 ] [ 4.293833343744e-14 1.6021766208e-15 1.057436569728e-14 ] [ -5.383313445888e-14 -3.620919163008e-14 -8.587666687488e-14 ] [ 6.16837999008e-14 0.0 1.2705260602944e-13 ] ] } "relaxed-potential-energy" { "source-value" -21.146068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.387973577144701e-18 } }