{ "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" [ [ 0.8164278 0.1663691 0.8726527 ] [ 0.2293415 1.783801 2.502887 ] [ 2.371717 0.4239938 0.3261347 ] [ 1.905698 2.704881 0.8462502 ] [ 2.020767 2.181943 2.752956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.164278e-11 1.663691e-11 8.726527e-11 ] [ 2.293415e-11 1.783801e-10 2.502887e-10 ] [ 2.371717e-10 4.239938e-11 3.261347e-11 ] [ 1.905698e-10 2.704881e-10 8.462502e-11 ] [ 2.020767e-10 2.181943e-10 2.752956e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -711.0941604 -46.548863 336.8018504 ] [ -158.2128303 -185.7582832 -132.4585665 ] [ 587.8093865 302.8218647 -184.695872 ] [ 87.9106982 -119.7431769 -136.1068281 ] [ 193.5869059 49.2284584 116.4594162 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.139298438980285e-06 -7.457950002342215e-08 5.396160505530591e-07 ] [ -2.534848978172579e-07 -2.976175784629854e-07 -2.122220184709821e-07 ] [ 9.417744565370911e-07 4.851741118894008e-07 -2.959154080766694e-07 ] [ 1.408484653742446e-07 -1.918497185294986e-07 -2.180671779130645e-07 ] [ 3.101604147259896e-07 7.887268512650537e-08 1.865885539076568e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 212.37889 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.40268492309455e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.1830188 -0.4930282 0.9172554 ] [ -0.2437287 1.2172071 3.1152993 ] [ 2.4069798 0.4785454 -0.5138822 ] [ 3.185545 2.9149436 0.6667052 ] [ 1.8121363 3.14332 3.1155029 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.830188e-11 -4.930282000000001e-11 9.172554000000001e-11 ] [ -2.437287e-11 1.2172071e-10 3.1152993e-10 ] [ 2.4069798e-10 4.785454000000001e-11 -5.138822e-11 ] [ 3.185545e-10 2.9149436e-10 6.667052e-11 ] [ 1.8121363e-10 3.14332e-10 3.1155029e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.41e-05 -4e-07 -2.57e-05 ] [ -1.2e-06 1.32e-05 2.13e-05 ] [ -2.36e-05 -1.7e-05 3.4e-06 ] [ 1.36e-05 7.9e-06 -5e-07 ] [ -1.3e-05 -3.6e-06 1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.861245656128e-14 -6.408706483200001e-16 -4.117593915456e-14 ] [ -1.92261194496e-15 2.114873139456e-14 3.412636202304e-14 ] [ -3.781136825088e-14 -2.72370025536e-14 5.44740051072e-15 ] [ 2.178960204288e-14 1.265719530432e-14 -8.010883104e-16 ] [ -2.08282960704e-14 -5.76783583488e-15 2.4032649312e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.190057 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.953062433161938e-18 } }