{ "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" [ [ 2.70835 3.598 3.116557 ] [ 5.398567 2.472121 1.998263 ] [ 3.170959 1.761622 1.993892 ] [ 5.798068 2.225895 4.322659 ] [ 3.522139 1.857386 4.354431 ] [ 3.141461 3.938126 0.8725825 ] [ 4.820562 4.158888 3.263025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70835e-10 3.598e-10 3.116557e-10 ] [ 5.398567e-10 2.472121e-10 1.998263e-10 ] [ 3.170959e-10 1.761622e-10 1.993892e-10 ] [ 5.798068e-10 2.225895e-10 4.322659e-10 ] [ 3.522139e-10 1.857386e-10 4.354431e-10 ] [ 3.141461e-10 3.938126e-10 8.725825e-11 ] [ 4.820562e-10 4.158888e-10 3.263025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5811246 2.9034246 1.5572517 ] [ -2.386142 -0.9007223 -1.1897725 ] [ 0.3521529 -1.7282839 -1.5601194 ] [ 1.0887728 0.039814 0.5048891 ] [ 1.8903955 0.386367 -1.3110867 ] [ 3.3936688 -1.3398695 1.5439822 ] [ -0.7577234 0.6392702 0.4548556 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.737594110291751e-09 4.651799014375592e-09 2.494992266441056e-09 ] [ -3.823020926308954e-09 -1.443116210893204e-09 -1.906225683570768e-09 ] [ 5.642111433269203e-10 -2.769016058685046e-09 -2.499586828336523e-09 ] [ 1.744406325522954e-09 6.37890599805312e-11 8.089215121167533e-10 ] [ 3.028747474165526e-09 6.190281744486337e-10 -2.100592458581823e-09 ] [ 5.437256810098391e-09 -2.146707587822986e-09 2.47373218377135e-09 ] [ -1.214006716513087e-09 1.02422376881414e-09 7.287590081599566e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -26.149376 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.189591887570862e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3064893 3.6594791 3.1543277 ] [ 5.2023183 2.1678228 2.0349873 ] [ 2.8424794 1.7008999 1.8413427 ] [ 6.0973539 2.4724775 4.2458161 ] [ 3.7562859 1.9560841 4.060435 ] [ 3.7064773 3.8644775 1.1933553 ] [ 4.6487019 4.1907971 3.3911452 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3064893e-10 3.6594791e-10 3.1543277e-10 ] [ 5.202318300000001e-10 2.1678228e-10 2.0349873e-10 ] [ 2.842479400000001e-10 1.7008999e-10 1.8413427e-10 ] [ 6.0973539e-10 2.4724775e-10 4.2458161e-10 ] [ 3.7562859e-10 1.9560841e-10 4.060435e-10 ] [ 3.7064773e-10 3.8644775e-10 1.1933553e-10 ] [ 4.6487019e-10 4.1907971e-10 3.3911452e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.58e-05 -2.9e-05 -3.95e-05 ] [ -2.7e-06 -7e-07 1.95e-05 ] [ -1.82e-05 5.48e-05 1.44e-05 ] [ -1.91e-05 2.52e-05 -6.9e-06 ] [ 3.22e-05 6e-06 -3.66e-05 ] [ -5.6e-06 -3.48e-05 4.44e-05 ] [ 4.92e-05 -2.14e-05 4.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.735792302464001e-14 -4.64631220032e-14 -6.32859765216e-14 ] [ -4.32587687616e-15 -1.12152363456e-15 3.12424441056e-14 ] [ -2.915961449856e-14 8.779927881984e-14 2.307134333952e-14 ] [ -3.060157345728e-14 4.037485084416e-14 -1.105501868352e-14 ] [ 5.159008718975999e-14 9.6130597248e-15 -5.863966432128e-14 ] [ -8.972189076479999e-15 -5.575574640383999e-14 7.113664196352e-14 ] [ 7.882708974336e-14 -3.428657968511999e-14 7.53023011776e-15 ] ] } "relaxed-potential-energy" { "source-value" -29.696934 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.757973336424062e-18 } }