{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.406773 2.709129 1.323095 ] [ 2.368678 1.150632 2.747721 ] [ 1.728543 3.608736 3.24956 ] [ 3.865166 3.131242 2.723008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.406773e-10 2.709129e-10 1.323095e-10 ] [ 2.368678e-10 1.150632e-10 2.747721e-10 ] [ 1.728543e-10 3.608736e-10 3.24956e-10 ] [ 3.865166e-10 3.131242e-10 2.723008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -63.6293927 126.7482623 -324.6935815 ] [ -11.8643191 -209.3633196 166.9097741 ] [ -58.6807634 49.6686812 77.631119 ] [ 134.1744752 32.9463762 80.1526883 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.019455253796422e-07 2.03073102584086e-07 -5.202164652031194e-07 ] [ -1.90087346837309e-08 -3.354370159161984e-07 2.674189378460293e-07 ] [ -9.40169472101763e-08 7.957799980460849e-08 1.243787639083427e-07 ] [ 2.149712072735494e-07 5.278591368772155e-08 1.284187632885297e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 158.03966 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.532074484111809e-17 } "relaxed-configuration-positions" { "source-value" [ [ 2.2274853 2.859397 0.5377053 ] [ 2.3265759 0.7221025 3.0429199 ] [ 1.3225384 3.8174894 3.5571694 ] [ 4.4925604 3.20075 2.9055895 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2274853e-10 2.859397e-10 5.377053000000001e-11 ] [ 2.3265759e-10 7.221025e-11 3.0429199e-10 ] [ 1.3225384e-10 3.8174894e-10 3.5571694e-10 ] [ 4.4925604e-10 3.200750000000001e-10 2.9055895e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.2e-06 3.6e-06 2.1e-06 ] [ 5.1e-06 3.1e-06 2.1e-06 ] [ 1.8e-06 -1.3e-06 -5.1e-06 ] [ -4.7e-06 -5.5e-06 1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.52478856576e-15 5.76783583488e-15 3.36457090368e-15 ] [ 8.17110076608e-15 4.96674752448e-15 3.36457090368e-15 ] [ 2.88391791744e-15 -2.08282960704e-15 -8.17110076608e-15 ] [ -7.53023011776e-15 -8.8119714144e-15 1.6021766208e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.5103029 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.363500834230644e-18 } }