{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0066411 1.299857 0.8298456 ] [ 0.9999642 1.240181 2.737035 ] [ 2.654666 1.132969 0.0147569 ] [ 2.745471 0.2375767 2.196855 ] [ 1.997397 2.884463 1.181944 ] [ 2.106064 2.994709 2.966195 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.6411e-13 1.299857e-10 8.298456e-11 ] [ 9.999642e-11 1.240181e-10 2.737035e-10 ] [ 2.654666e-10 1.132969e-10 1.47569e-12 ] [ 2.745471000000001e-10 2.375767e-11 2.196855e-10 ] [ 1.997397e-10 2.884463e-10 1.181944e-10 ] [ 2.106064e-10 2.994709e-10 2.966195e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8623415 0.4946997 -2.5592721 ] [ -4.1519443 -2.955647 2.9508976 ] [ 0.0853978 -2.0089478 -0.3034191 ] [ 3.2773532 -1.9899896 -1.262079 ] [ -1.3486909 1.4381916 -11.8813585 ] [ 3.0002257 5.0216931 13.0552312 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.381623401828511e-09 7.925963001868097e-10 -4.100405958668111e-09 ] [ -6.652148143129486e-09 -4.735468561752198e-09 4.727859184046678e-09 ] [ 1.368223597550052e-10 -3.218689224085705e-09 -4.861309923293093e-10 ] [ 5.250898718405128e-09 -3.188314839023006e-09 -2.022073484062086e-09 ] [ -2.160841046468431e-09 2.304236976735074e-09 -1.903603496887729e-08 ] [ 4.806891513266294e-09 8.045639347939025e-09 2.091678638010777e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.13044505564262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.623076236017143e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5055118 0.9355398 0.5726555 ] [ 0.6627702 1.5440662 2.8199986 ] [ 2.6984111 1.5814134 -0.0141441 ] [ 2.5343036 0.1614797 2.6079546 ] [ 1.3035975 3.070478 1.1244452 ] [ 2.8056092 2.4967786 2.8157217 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.055118e-11 9.355398000000001e-11 5.726555e-11 ] [ 6.627702e-11 1.5440662e-10 2.8199986e-10 ] [ 2.6984111e-10 1.5814134e-10 -1.41441e-12 ] [ 2.5343036e-10 1.614797e-11 2.6079546e-10 ] [ 1.3035975e-10 3.070478e-10 1.1244452e-10 ] [ 2.8056092e-10 2.4967786e-10 2.8157217e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0001478 -0.0002169 -3.44e-05 ] [ -0.0001127 -5e-06 7.79e-05 ] [ 8.81e-05 6.89e-05 -0.0001393 ] [ 1.84e-05 3.4e-05 3.22e-05 ] [ 7.06e-05 0.0001584 -2.67e-05 ] [ 8.34e-05 -3.94e-05 9.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.368017065051999e-13 -3.475121119146e-13 -5.51148762096e-14 ] [ -1.805653066518e-13 -8.010883169999999e-15 1.248095597886e-13 ] [ 1.411517614554e-13 1.103899700826e-13 -2.231832051162e-13 ] [ 2.94800500656e-14 5.447400555599999e-14 5.159008761479998e-14 ] [ 1.131136703604e-13 2.537847788256e-13 -4.277811612779999e-14 ] [ 1.336215312756e-13 -6.31257593796e-14 1.445163323868e-13 ] ] } "relaxed-potential-energy" { "source-value" -15.10006605564262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.419297300620715e-18 } }