{ "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" [ [ 2.384535 1.809355 2.901981 ] [ 1.948299 3.967012 2.633856 ] [ 1.645033 3.274995 4.707865 ] [ 4.440095 1.758867 2.666287 ] [ 3.649735 2.240012 5.07701 ] [ 4.164388 4.024114 1.736165 ] [ 3.303688 4.596831 4.046686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.384535e-10 1.809355e-10 2.901981e-10 ] [ 1.948299e-10 3.967012e-10 2.633856000000001e-10 ] [ 1.645033e-10 3.274995e-10 4.707865e-10 ] [ 4.440095e-10 1.758867e-10 2.666287e-10 ] [ 3.649735e-10 2.240012e-10 5.07701e-10 ] [ 4.164388e-10 4.024114e-10 1.736165e-10 ] [ 3.303688e-10 4.596831e-10 4.046686e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4871 -2.3325042 0.1806818 ] [ -3.2864914 1.1054676 -5.2755106 ] [ -2.2732357 -1.0874185 2.4340623 ] [ 3.4065421 0.6510351 -0.0446658 ] [ 1.0542458 -0.2225208 -0.5668234 ] [ 0.0694679 -0.5916446 0.7611712 ] [ 4.5165714 2.4775854 2.5110844 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.58695009439168e-09 -3.737083697157807e-09 2.894841557640615e-10 ] [ -5.265539685540261e-09 1.771154343771886e-09 -8.45229974610258e-09 ] [ -3.642125092107922e-09 -1.742236497725405e-09 3.899797710630676e-09 ] [ 5.457882110390936e-09 1.04307321654019e-09 -7.156250050932865e-11 ] [ 1.689087973336593e-09 -3.565176234017126e-10 -9.081511996023666e-10 ] [ 1.112998452760723e-10 -9.479191459425677e-10 1.219530701066281e-09 ] [ 7.236345103253925e-09 3.969529403915416e-09 4.023200718535596e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.473179 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.600600198885353e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1338512 1.6076524 3.0263519 ] [ 1.8513429 3.916321 2.3632756 ] [ 1.5677122 3.2832053 4.6906413 ] [ 4.4712936 1.8206176 2.6376839 ] [ 3.7983353 2.3380017 4.8601747 ] [ 4.1974008 4.0587341 1.9947354 ] [ 3.515837 4.6466539 4.1969871 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1338512e-10 1.6076524e-10 3.0263519e-10 ] [ 1.8513429e-10 3.916321e-10 2.3632756e-10 ] [ 1.5677122e-10 3.2832053e-10 4.6906413e-10 ] [ 4.4712936e-10 1.8206176e-10 2.6376839e-10 ] [ 3.7983353e-10 2.3380017e-10 4.8601747e-10 ] [ 4.1974008e-10 4.0587341e-10 1.9947354e-10 ] [ 3.515837e-10 4.6466539e-10 4.196987100000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.95e-05 -2.83e-05 5.14e-05 ] [ 2.87e-05 -2.75e-05 5.11e-05 ] [ 5.56e-05 -1.63e-05 -7.88e-05 ] [ -1.78e-05 -1.4e-05 -2.74e-05 ] [ -6.3e-05 7.02e-05 -2.39e-05 ] [ 1.16e-05 4.19e-05 -9.3e-06 ] [ 4.5e-06 -2.59e-05 3.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.12424441056e-14 -4.534159836864e-14 8.235187830912e-14 ] [ 4.598246901696e-14 -4.4059857072e-14 8.187122532288001e-14 ] [ 8.908102011648e-14 -2.611547891904e-14 -1.2625151771904e-13 ] [ -2.851874385024e-14 -2.24304726912e-14 -4.389963940992e-14 ] [ -1.009371271104e-13 1.1247279878016e-13 -3.829202123712e-14 ] [ 1.858524880128e-14 6.713120041152e-14 -1.490024257344e-14 ] [ 7.2097947936e-15 -4.149637447872e-14 5.879988198335999e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.628085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.945854200207517e-18 } }