{ "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" [ [ 2.690681 1.842727 3.696963 ] [ 2.658202 3.646198 2.018485 ] [ 5.329976 0.2810446 1.792372 ] [ 5.111587 2.700534 2.069297 ] [ 3.393505 1.493232 0.8693091 ] [ 5.014849 1.504764 3.993476 ] [ 3.843884 3.656776 4.040771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.690681e-10 1.842727e-10 3.696963e-10 ] [ 2.658202e-10 3.646198e-10 2.018485e-10 ] [ 5.329976000000001e-10 2.810446e-11 1.792372e-10 ] [ 5.111587e-10 2.700534e-10 2.069297e-10 ] [ 3.393505e-10 1.493232e-10 8.693091e-11 ] [ 5.014849e-10 1.504764e-10 3.993476e-10 ] [ 3.843884e-10 3.656776e-10 4.040771000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.2687875 -9.168181 2.4920563 ] [ -1.3130964 3.5603139 -7.4055644 ] [ 2.9195012 -6.0878914 -0.6959117 ] [ 2.413842 6.7699521 -2.1962237 ] [ -4.6357932 0.4141109 -2.5804248 ] [ 7.5875486 -6.2636253 4.7925253 ] [ 2.2967853 10.7753208 5.5935429 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.485023463566328e-08 -1.468904525346277e-08 3.992714341577351e-09 ] [ -2.103812352936645e-09 5.704251693289269e-09 -1.186502214550878e-08 ] [ 4.677556567037546e-09 -9.753877271049381e-09 -1.114973455881183e-09 ] [ 3.867401218705113e-09 1.084665897855587e-08 -3.518738266186873e-09 ] [ -7.427359483903619e-09 6.634788023984468e-10 -4.134296286292516e-09 ] [ 1.215659297610377e-08 -1.003543401711139e-08 7.678471990252508e-09 ] [ 3.679855710657114e-09 1.726396706737995e-08 8.961843661821832e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.807198 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.493898280075652e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4579627 1.7975607 4.0771785 ] [ 2.669392 3.2238656 2.04209 ] [ 5.1635765 0.3286775 1.8358706 ] [ 5.1762633 2.9333109 2.0042623 ] [ 3.5745172 1.5887486 0.4424463 ] [ 4.9249674 1.435288 4.01996 ] [ 4.0760049 3.8178244 4.0588653 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4579627e-10 1.7975607e-10 4.077178499999999e-10 ] [ 2.669392e-10 3.2238656e-10 2.04209e-10 ] [ 5.163576499999999e-10 3.286775000000001e-11 1.8358706e-10 ] [ 5.1762633e-10 2.9333109e-10 2.0042623e-10 ] [ 3.5745172e-10 1.5887486e-10 4.424463e-11 ] [ 4.9249674e-10 1.435288e-10 4.01996e-10 ] [ 4.0760049e-10 3.8178244e-10 4.0588653e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0001168 -7.5e-05 3.83e-05 ] [ 2.3e-05 3.39e-05 -6.7e-05 ] [ 8.1e-06 -5.28e-05 8.06e-05 ] [ -8e-07 1.44e-05 -6.45e-05 ] [ -7.5e-06 3.78e-05 3.02e-05 ] [ 9.06e-05 -2.08e-05 -8.85e-05 ] [ 3.4e-06 6.24e-05 7.1e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.8713422930944e-13 -1.2016324656e-13 6.136336457664001e-14 ] [ 3.68500622784e-14 5.431378744512e-14 -1.073458335936e-13 ] [ 1.297763062848e-14 -8.459492557824e-14 1.2913543563648e-13 ] [ -1.28174129664e-15 2.307134333952e-14 -1.033403920416e-13 ] [ -1.2016324656e-14 6.056227626623999e-14 4.838573394816e-14 ] [ 1.4515720184448e-13 -3.332527371264e-14 -1.417926309408e-13 ] [ 5.44740051072e-15 9.997582113791999e-14 1.137545400768e-13 ] ] } "relaxed-potential-energy" { "source-value" -25.928743 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.154242584133166e-18 } }