{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.743488 1.903222 1.191758 ] [ 2.092285 1.109675 3.649357 ] [ 1.94045 3.241003 2.726585 ] [ 4.050079 0.1031898 2.277213 ] [ 5.000478 2.032764 2.106801 ] [ 4.158728 1.007331 4.48257 ] [ 3.981083 3.39009 3.613579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743488e-10 1.903222e-10 1.191758e-10 ] [ 2.092285e-10 1.109675e-10 3.649357e-10 ] [ 1.94045e-10 3.241003e-10 2.726585e-10 ] [ 4.050079e-10 1.031898e-11 2.277213e-10 ] [ 5.000478000000001e-10 2.032764e-10 2.106801e-10 ] [ 4.158728e-10 1.007331e-10 4.48257e-10 ] [ 3.981083e-10 3.39009e-10 3.613579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3415892 -1.3811558 -1.7728234 ] [ 2.7344027 0.95964 1.0969214 ] [ -0.5825664 -0.0780848 1.6311933 ] [ -0.5245095 -0.9330372 0.3621708 ] [ -0.5111098 4.1265221 3.6715273 ] [ -3.0712458 -0.5814869 -1.7856933 ] [ 2.296618 -2.1123973 -3.2032962 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.472862301577753e-10 -2.212855532442321e-09 -2.840376204287167e-09 ] [ 4.380996077792396e-09 1.537512772384512e-09 1.757461821935205e-09 ] [ -9.333742661436212e-10 -1.251056409998438e-10 2.613459769265601e-09 ] [ -8.403568582874975e-10 -1.494890388176694e-09 5.802615884964326e-10 ] [ -8.188881722217638e-10 6.61141723383452e-09 5.882435202688948e-09 ] [ -4.920678217490192e-09 -9.316447164814676e-10 -2.860996057179201e-09 ] [ 3.679587666508455e-09 -3.384433567901044e-09 -5.132246281137481e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.725988 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.878710382938135e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7761016 2.357995 0.7110148 ] [ 1.876802 1.3637068 4.3894263 ] [ 2.1594513 2.8925913 2.8184716 ] [ 5.0740969 0.2451856 2.8872787 ] [ 5.5866913 2.3032276 2.2781725 ] [ 3.3525907 -0.2626078 4.1770401 ] [ 4.1408573 3.8871762 2.786459 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7761016e-10 2.357995e-10 7.110148e-11 ] [ 1.876802e-10 1.3637068e-10 4.3894263e-10 ] [ 2.1594513e-10 2.8925913e-10 2.8184716e-10 ] [ 5.0740969e-10 2.451856e-11 2.8872787e-10 ] [ 5.5866913e-10 2.3032276e-10 2.2781725e-10 ] [ 3.3525907e-10 -2.626078e-11 4.1770401e-10 ] [ 4.140857300000001e-10 3.8871762e-10 2.786459e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.3495164 0.137467 0.0370616 ] [ -0.09913 -0.1284835 -0.024716 ] [ 0.0322177 0.1946748 -0.1715368 ] [ -0.2061316 -0.0673773 0.3792524 ] [ 0.3372734 -0.4537511 0.1375592 ] [ 0.5312176 0.1224341 -0.3209529 ] [ -0.2459307 0.1950361 -0.0366674 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.599870046661811e-10 2.202464135315136e-10 5.937922904944128e-11 ] [ -1.58823768419904e-10 -2.058532598585568e-10 -3.95993973596928e-11 ] [ 5.161844571594817e-11 3.119034132189159e-10 -2.748322505668454e-10 ] [ -3.302592303280973e-10 -1.079503348326278e-10 6.076293286622899e-10 ] [ 5.403715562977267e-10 -7.269894040822829e-10 2.203941342159513e-10 ] [ 8.51104419277486e-10 1.961610526086893e-10 -5.142232327579603e-10 ] [ -3.940244178769785e-10 3.124822796320108e-10 -5.874765102552192e-11 ] ] } "relaxed-potential-energy" { "source-value" -16.216265 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.598132065969731e-18 } }