{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.441642 1.737365 1.840337 ] [ 1.815126 3.688812 0.8905128 ] [ 2.603472 3.479991 3.236515 ] [ 3.869651 3.231599 1.101882 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.441642e-10 1.737365e-10 1.840337e-10 ] [ 1.815126e-10 3.688812e-10 8.905128000000001e-11 ] [ 2.603472e-10 3.479991e-10 3.236515e-10 ] [ 3.869651e-10 3.231599e-10 1.101882e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7758069 -7.0695425 3.9144582 ] [ -6.1731202 5.9624744 -4.0637841 ] [ -0.0470818 -0.3789305 1.6805347 ] [ 6.9960089 1.4859986 -1.5312088 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.242979677435323e-09 -1.132665571325198e-08 6.271653411138851e-09 ] [ -9.89042886182822e-09 9.552937085798506e-09 -6.51089987699877e-09 ] [ -7.543335922518144e-11 -6.071135880080544e-10 2.692513406783142e-09 ] [ 1.120884189848873e-08 2.380832215461531e-09 -2.453266940923223e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.1640976 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.67161982144939e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.9978826 2.2094285 2.603218 ] [ 2.3572793 4.6470832 -0.8437321 ] [ 2.3863729 2.180287 4.7183272 ] [ 2.9883562 3.1009683 0.5914337 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9978826e-10 2.2094285e-10 2.603218e-10 ] [ 2.3572793e-10 4.6470832e-10 -8.437321000000001e-11 ] [ 2.3863729e-10 2.180287e-10 4.7183272e-10 ] [ 2.9883562e-10 3.1009683e-10 5.914337e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0938588 -0.0076175 0.3321328 ] [ 0.0963196 -0.1852026 0.1026533 ] [ 0.0948267 -0.0473274 -0.2091411 ] [ -0.0972874 0.2401475 -0.2256451 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.503783750163431e-10 -1.2204580408944e-11 5.321354071608422e-10 ] [ 1.543210112448077e-10 -2.967272758313741e-10 1.644687173079687e-10 ] [ 1.519291217676154e-10 -7.582685380324993e-11 -3.350809808683949e-10 ] [ -1.558715977784179e-10 3.84758710043568e-10 -3.615233038180781e-10 ] ] } "relaxed-potential-energy" { "source-value" -8.3838771 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.34324518812805e-18 } }