{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.049795 0.7119441 0.3423404 ] [ 0.1447331 1.623908 1.772641 ] [ 2.54973 0.1092944 1.824085 ] [ 1.77811 2.382187 0.8238028 ] [ 2.019176 2.140924 2.983896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.9795e-12 7.119441e-11 3.423404e-11 ] [ 1.447331e-11 1.623908e-10 1.772641e-10 ] [ 2.54973e-10 1.092944e-11 1.824085e-10 ] [ 1.77811e-10 2.382187e-10 8.238028e-11 ] [ 2.019176e-10 2.140924e-10 2.983896e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7811532 -16.2270083 -24.4910424 ] [ -9.0459955 11.392735 27.3951086 ] [ 0.6991513 -0.3471591 -0.4682608 ] [ 8.6017978 4.6125459 -9.4531 ] [ 2.5261996 0.5688864 7.0172947 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.455898672614328e-09 -2.599853353798406e-08 -3.923897587558328e-08 ] [ -1.449328262136915e-08 1.825317381435399e-08 4.389180288481245e-08 ] [ 1.120163876490724e-09 -5.562101983004694e-10 -7.502365123781471e-10 ] [ 1.37815994455526e-08 7.390113264232499e-09 -1.51455359388654e-08 ] [ 4.047417971940146e-09 9.114564974803775e-10 1.124294560223204e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.95468467 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.529573471112001e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.2248895 1.4005604 0.0863467 ] [ -0.6108674 1.6966231 2.3955909 ] [ 3.5297601 0.3770082 2.0509971 ] [ 2.1293781 1.5893214 0.3767972 ] [ 1.7181629 1.9047444 2.8370333 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.248895e-11 1.4005604e-10 8.63467e-12 ] [ -6.108674e-11 1.6966231e-10 2.3955909e-10 ] [ 3.5297601e-10 3.770082e-11 2.0509971e-10 ] [ 2.1293781e-10 1.5893214e-10 3.767972e-11 ] [ 1.7181629e-10 1.9047444e-10 2.8370333e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.6e-06 2.4e-06 -5.6e-06 ] [ -3e-07 3.9e-06 1.2e-06 ] [ 9e-06 2.5e-06 -9e-07 ] [ -3.5e-06 -5.9e-06 -9e-07 ] [ -3.6e-06 -2.8e-06 6.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.5634826144e-15 3.845223921599999e-15 -8.972189150399999e-15 ] [ -4.806529901999999e-16 6.248488872599999e-15 1.9226119608e-15 ] [ 1.4419589706e-14 4.005441585e-15 -1.4419589706e-15 ] [ -5.607618218999999e-15 -9.452842140600001e-15 -1.4419589706e-15 ] [ -5.767835882399999e-15 -4.486094575199999e-15 1.00937127942e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.146626 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.785886372513688e-18 } }