{ "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" [ [ 2.146483 1.678803 1.689789 ] [ 0.9939717 3.024801 3.865516 ] [ 2.198915 3.863733 1.927968 ] [ 4.22715 2.33689 1.172014 ] [ 3.633184 2.755923 3.714191 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146483e-10 1.678803e-10 1.689789e-10 ] [ 9.939717000000001e-11 3.024801e-10 3.865516e-10 ] [ 2.198915e-10 3.863733e-10 1.927968e-10 ] [ 4.22715e-10 2.33689e-10 1.172014e-10 ] [ 3.633184e-10 2.755923e-10 3.714191e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.8417029 -17.5132327 -12.5142246 ] [ -9.3193847 2.052307 9.2905051 ] [ -9.1986042 18.8786261 -6.181405 ] [ 13.8346253 -4.231069 -8.7572269 ] [ 13.5250665 0.8133686 18.1623514 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.416596967443956e-08 -2.805929198657006e-08 -2.004999808156023e-08 ] [ -1.493130028658122e-08 3.288158294104185e-09 1.488503006664317e-08 ] [ -1.473778859323269e-08 3.024689337024469e-08 -9.903702574696224e-09 ] [ 2.216551321318819e-08 -6.778919832791635e-09 -1.403062420222086e-08 ] [ 2.166954534106528e-08 1.303160155012827e-09 2.909929479183415e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.3170027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.916600797870476e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3837381 2.2188837 0.5570948 ] [ 1.8026112 3.6873724 4.0196272 ] [ 0.8705558 3.4474934 1.8735006 ] [ 4.2509761 1.6994104 1.889647 ] [ 3.8918225 2.6069902 4.0296084 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3837381e-10 2.2188837e-10 5.570948e-11 ] [ 1.8026112e-10 3.6873724e-10 4.0196272e-10 ] [ 8.705558e-11 3.4474934e-10 1.8735006e-10 ] [ 4.2509761e-10 1.6994104e-10 1.889647e-10 ] [ 3.8918225e-10 2.6069902e-10 4.0296084e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.6e-06 -1.2e-06 -2.4e-06 ] [ 2.7e-06 -3.8e-06 -3.3e-06 ] [ 1.3e-06 2.5e-06 3.8e-06 ] [ 3e-06 2e-07 2.3e-06 ] [ -4.3e-06 2.3e-06 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.16565921408e-15 -1.92261194496e-15 -3.84522388992e-15 ] [ 4.32587687616e-15 -6.08827115904e-15 -5.28718284864e-15 ] [ 2.08282960704e-15 4.005441552e-15 6.08827115904e-15 ] [ 4.8065298624e-15 3.2043532416e-16 3.68500622784e-15 ] [ -6.889359469440001e-15 3.68500622784e-15 -6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }