{ "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" [ [ 6.1635306 -3.9961649 6.4141766 ] [ 5.5068096 4.0115526 -6.2001752 ] [ 1.3397812 -2.6938323 2.6246908 ] [ -6.4458009 2.912092 4.1110499 ] [ -5.0144158 3.3949962 2.5231575 ] [ -0.4640845 3.6549414 -8.0187068 ] [ -1.0858202 -7.2835849 -1.4541926 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.875064628905396e-09 -6.40256197564157e-09 1.027664379020243e-08 ] [ 8.822881596317e-09 6.427215788829454e-09 -9.933775750303964e-09 ] [ 2.146566115627369e-09 -4.315995131415892e-09 4.205218236588849e-09 ] [ -1.03273115043116e-08 4.665685720018714e-09 6.586628036722179e-09 ] [ -8.03397976173013e-09 5.439383539344841e-09 4.042543957096176e-09 ] [ -7.435453359756576e-10 5.855861661474021e-09 -1.284738456400998e-08 ] [ -1.73967573883238e-09 -1.166958944239191e-08 -2.329873385860366e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -38.017367 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.091053659177344e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0418924 2.0493323 1.5592616 ] [ 2.3240209 1.3254472 3.5249387 ] [ 1.6080226 3.2600785 2.7286916 ] [ 3.7548586 0.1199022 2.3563146 ] [ 5.1274829 1.8486993 2.2494567 ] [ 4.4110027 1.1262158 4.2113256 ] [ 3.699311 3.0575995 3.4178741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0418924e-10 2.0493323e-10 1.5592616e-10 ] [ 2.3240209e-10 1.3254472e-10 3.5249387e-10 ] [ 1.6080226e-10 3.2600785e-10 2.7286916e-10 ] [ 3.7548586e-10 1.199022e-11 2.3563146e-10 ] [ 5.1274829e-10 1.8486993e-10 2.2494567e-10 ] [ 4.4110027e-10 1.1262158e-10 4.211325600000001e-10 ] [ 3.699311e-10 3.0575995e-10 3.4178741e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.34e-05 -5.6e-06 -3.71e-05 ] [ -1.4e-05 -3.35e-05 2.4e-06 ] [ -1.28e-05 -1.62e-05 2.63e-05 ] [ -2.8e-05 5.74e-05 4.21e-05 ] [ 9.4e-06 9e-07 2.18e-05 ] [ -7.5e-06 -6.5e-06 -3.23e-05 ] [ 2.95e-05 3.5e-06 -2.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.749093292672001e-14 -8.972189076479999e-15 -5.944075263168e-14 ] [ -2.24304726912e-14 -5.36729167968e-14 3.84522388992e-15 ] [ -2.050786074624e-14 -2.595526125696e-14 4.213724512704e-14 ] [ -4.48609453824e-14 9.196493803392e-14 6.745163573568001e-14 ] [ 1.506046023552e-14 1.44195895872e-15 3.492745033344e-14 ] [ -1.2016324656e-14 -1.04141480352e-14 -5.175030485184e-14 ] [ 4.72642103136e-14 5.6076181728e-15 -3.701027994048e-14 ] ] } "relaxed-potential-energy" { "source-value" -50.517683 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.093825063958561e-18 } }