{ "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" [ [ 2.819728 1.352428 1.364201 ] [ 2.130711 2.142985 3.535598 ] [ 2.900765 3.536828 2.247591 ] [ 4.867849 2.542824 1.805581 ] [ 4.180951 2.552465 4.619841 ] [ 3.604443 0.2919785 5.062878 ] [ 4.799237 0.5958561 3.34882 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.819728e-10 1.352428e-10 1.364201e-10 ] [ 2.130711e-10 2.142985e-10 3.535598e-10 ] [ 2.900765e-10 3.536828e-10 2.247591e-10 ] [ 4.867849e-10 2.542824e-10 1.805581e-10 ] [ 4.180951e-10 2.552465e-10 4.619841e-10 ] [ 3.604443e-10 2.919785e-11 5.062878e-10 ] [ 4.799237e-10 5.958561e-11 3.34882e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.8542535 -9.9029022 -13.8308595 ] [ -17.2396417 -1.4054384 7.394157 ] [ -5.2957592 18.1612792 -5.9134358 ] [ 14.650477 4.9408706 -9.3433647 ] [ 6.833158 10.988494 12.8290798 ] [ -4.0143901 -11.0995896 12.4626118 ] [ 11.9204095 -11.6827135 -3.5981887 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.098172471073657e-08 -1.586619838290889e-08 -2.215947973646958e-08 ] [ -2.762095088270877e-08 -2.251760546454559e-09 1.184674547592467e-08 ] [ -8.484741579626512e-09 2.909757693806133e-08 -9.474368587361745e-09 ] [ 2.347265173296812e-08 7.916147361718068e-09 -1.496972048194801e-08 ] [ 1.094792599383249e-08 1.760550818460107e-08 2.055445172193754e-08 ] [ -6.431761964990974e-09 -1.778350295759482e-08 1.99673052600662e-08 ] [ 1.909860141126222e-08 -1.871777043720454e-08 -5.764933812366745e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 82.500928 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.321810580359041e-17 } "relaxed-configuration-positions" { "source-value" [ [ 2.1084709 0.269398 -0.223723 ] [ -0.3339215 2.0649483 4.4319197 ] [ 2.0906091 5.9940719 1.4430004 ] [ 6.9047771 3.5621805 0.3661114 ] [ 5.0331207 3.7964456 5.9000168 ] [ 2.9868174 -1.3805525 7.1432324 ] [ 6.5138103 -1.2911271 2.9239523 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1084709e-10 2.69398e-11 -2.23723e-11 ] [ -3.339215e-11 2.0649483e-10 4.4319197e-10 ] [ 2.0906091e-10 5.9940719e-10 1.4430004e-10 ] [ 6.9047771e-10 3.5621805e-10 3.661114e-11 ] [ 5.0331207e-10 3.7964456e-10 5.900016800000001e-10 ] [ 2.9868174e-10 -1.3805525e-10 7.1432324e-10 ] [ 6.5138103e-10 -1.2911271e-10 2.9239523e-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 ] [ -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 ] [ 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 } }