{ "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" [ [ 0.3237917 -0.2399593 2.5187344 ] [ -2.0948992 0.4899958 -3.2366143 ] [ 1.5320482 -2.4212995 -1.0045227 ] [ 2.2978153 -1.4391432 0.4227828 ] [ -2.6121331 1.7288462 1.1362458 ] [ 0.544344 0.1540072 1.68762 ] [ 0.0090331 1.7275528 -1.524246 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.187714960231378e-10 -3.844571835709962e-10 4.035457402932009e-09 ] [ -3.356398548825292e-09 7.850598215181371e-10 -5.185627804730266e-09 ] [ 2.454611828201758e-09 -3.879349482815882e-09 -1.609422798262592e-09 ] [ 3.6815059829077e-09 -2.305761608019989e-09 6.773727234170951e-10 ] [ -4.185098617717984e-09 2.769916985419691e-09 1.820466471240637e-09 ] [ 8.72135237658096e-10 2.467467373077648e-10 2.70386533107108e-09 ] [ 1.44726217525854e-11 2.767844730161275e-09 -2.442111325667964e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.680068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.434835817713111e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3801416 2.3072053 1.4100444 ] [ 2.700518 1.6635676 3.6741538 ] [ 1.2911722 4.2536123 2.0563343 ] [ 2.2822244 3.9560875 4.1351159 ] [ 4.5502917 1.9967903 2.185483 ] [ 3.6854188 4.2628422 2.136785 ] [ 4.4791584 3.1946476 4.1651596 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3801416e-10 2.3072053e-10 1.4100444e-10 ] [ 2.700518e-10 1.6635676e-10 3.6741538e-10 ] [ 1.2911722e-10 4.253612300000001e-10 2.0563343e-10 ] [ 2.2822244e-10 3.956087500000001e-10 4.1351159e-10 ] [ 4.5502917e-10 1.9967903e-10 2.185483e-10 ] [ 3.6854188e-10 4.2628422e-10 2.136785e-10 ] [ 4.4791584e-10 3.1946476e-10 4.1651596e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.62e-05 8.06e-05 -1.16e-05 ] [ -4.4e-06 -8e-06 1.77e-05 ] [ -4.67e-05 -1.81e-05 -6.3e-06 ] [ -4.54e-05 4.14e-05 -1.37e-05 ] [ 7.68e-05 -2.42e-05 1.41e-05 ] [ -1.69e-05 -3.25e-05 -1.56e-05 ] [ 6.28e-05 -3.91e-05 1.54e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.197702781079999e-14 1.291354367004e-13 -1.85852489544e-14 ] [ -7.0495771896e-15 -1.2817413072e-14 2.83585264218e-14 ] [ -7.482164880779999e-14 -2.899939707539999e-14 -1.00937127942e-14 ] [ -7.273881918359998e-14 6.633011264759999e-14 -2.19498198858e-14 ] [ 1.230471654912e-13 -3.877267454279999e-14 2.25906905394e-14 ] [ -2.70767851146e-14 -5.207074060499999e-14 -2.49939554904e-14 ] [ 1.006166926152e-13 -6.26451063894e-14 2.46735201636e-14 ] ] } "relaxed-potential-energy" { "source-value" -30.380528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.867497209018275e-18 } }