{ "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" [ [ 2.990348 2.100415 1.411886 ] [ 2.946969 3.752547 2.888488 ] [ 5.496135 2.06422 2.457996 ] [ 4.937229 4.674633 2.559339 ] [ 4.468449 3.37128 4.359326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.990348e-10 2.100415e-10 1.411886e-10 ] [ 2.946969e-10 3.752547e-10 2.888488e-10 ] [ 5.496135e-10 2.06422e-10 2.457996e-10 ] [ 4.937229e-10 4.674633e-10 2.559339e-10 ] [ 4.468449e-10 3.37128e-10 4.359326000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5424049 -1.0886885 -1.018468 ] [ -6.1141388 -0.0638726 -2.2548164 ] [ 0.0 0.0 0.0 ] [ 3.7602739 3.3124195 -2.3740077 ] [ 2.8962697 -2.1598584 5.6472922 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.690284569471065e-10 -1.744271276404509e-09 -1.631765632076712e-09 ] [ -9.795930322392798e-09 -1.023351872728284e-10 -3.612614150039997e-09 ] [ 0.0 0.0 0.0 ] [ 6.024622980020052e-09 5.307081124905963e-09 -3.803579665876081e-09 ] [ 4.640335639102189e-09 -3.460474661228626e-09 9.047959608210454e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.741667 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.199164707608877e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.9667257 2.0487089 1.3638573 ] [ 2.8061287 3.7650417 2.8467456 ] [ 5.496135 2.06422 2.457996 ] [ 5.0294348 4.7595854 2.5099024 ] [ 4.5407059 3.3255389 4.4985337 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9667257e-10 2.0487089e-10 1.3638573e-10 ] [ 2.8061287e-10 3.7650417e-10 2.8467456e-10 ] [ 5.496135e-10 2.06422e-10 2.457996e-10 ] [ 5.0294348e-10 4.7595854e-10 2.5099024e-10 ] [ 4.5407059e-10 3.3255389e-10 4.4985337e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.438761 -0.5289424 -0.5121456 ] [ -0.186146 0.0600349 -0.1176218 ] [ 0.0 0.0 0.0 ] [ 0.3061343 0.3867433 0.1308053 ] [ 0.3187727 0.0821643 0.4989621 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.029726221104739e-10 -8.474591540118816e-10 -8.205477135259104e-10 ] [ -2.98238771712564e-10 9.61865140045266e-11 -1.884508996090212e-10 ] [ 0.0 0.0 0.0 ] [ 4.904812223259462e-10 6.196310786160521e-10 2.095731952633602e-10 ] [ 5.107301714970917e-10 1.316417216089662e-10 7.994254178715713e-10 ] ] } "relaxed-potential-energy" { "source-value" -7.1122896 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.139514421136121e-18 } }