{ "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" [ [ 1.62041 2.509202 2.566624 ] [ 2.85955 3.94705 0.1409863 ] [ 3.121365 1.927989 0.779992 ] [ 4.065015 5.453159 1.199522 ] [ 3.840762 3.584521 2.337034 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.62041e-10 2.509202e-10 2.566624e-10 ] [ 2.85955e-10 3.94705e-10 1.409863e-11 ] [ 3.121365e-10 1.927989e-10 7.79992e-11 ] [ 4.065015e-10 5.453159000000001e-10 1.199522e-10 ] [ 3.840762e-10 3.584521e-10 2.337034e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2201381 -1.7790756 3.8558191 ] [ -2.745092 2.2565206 -6.4399514 ] [ 1.0647779 -7.0551831 -2.9830735 ] [ 2.925969 6.7350256 -0.2678382 ] [ 3.9744832 -0.1572874 5.8350441 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.363583221167333e-09 -2.850393332955732e-09 6.177703216054098e-09 ] [ -4.398122224345114e-09 3.615344549673589e-09 -1.031793957216823e-08 ] [ 1.70596225772452e-09 -1.130364941828327e-08 -4.779410619828029e-09 ] [ 4.687919124985555e-09 1.079070055680949e-08 -4.291241021971546e-10 ] [ 6.367824062802371e-09 -2.520021950264179e-10 9.348771238356979e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 30.220359 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.841835266198287e-18 } "relaxed-configuration-positions" { "source-value" [ [ -1.0538816 2.1029069 3.9242654 ] [ 0.8759135 4.7990401 -2.8456677 ] [ 4.0797426 -1.3464626 -0.398062 ] [ 5.4727526 8.9550073 1.1064844 ] [ 6.1325749 2.9114294 5.2371382 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.0538816e-10 2.1029069e-10 3.9242654e-10 ] [ 8.759135000000001e-11 4.7990401e-10 -2.8456677e-10 ] [ 4.0797426e-10 -1.3464626e-10 -3.980620000000001e-11 ] [ 5.4727526e-10 8.9550073e-10 1.1064844e-10 ] [ 6.1325749e-10 2.9114294e-10 5.237138200000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 -0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 -0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }