{ "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" [ [ 2.114 2.095272 1.915779 ] [ 2.14246 0.9228837 3.956719 ] [ 3.791491 3.03012 0.940196 ] [ 4.524648 0.3016751 5.057567 ] [ 3.666195 2.4276 3.537085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.114e-10 2.095272e-10 1.915779e-10 ] [ 2.14246e-10 9.228837e-11 3.956719e-10 ] [ 3.791491000000001e-10 3.03012e-10 9.40196e-11 ] [ 4.524648e-10 3.016751e-11 5.057567e-10 ] [ 3.666195e-10 2.4276e-10 3.537085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -203.627331 -91.6264782 59.3129825 ] [ -67.9592358 -64.326596 33.4707472 ] [ 183.2844184 101.9266402 -111.8196107 ] [ 10.6475778 5.4949581 -1.2571666 ] [ 77.6545706 48.5314758 20.2930476 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.262469490841031e-07 -1.468018012182809e-07 9.502987387141953e-08 ] [ -1.088826987661944e-07 -1.030625682068468e-07 5.362604864454706e-08 ] [ 2.936540101174054e-07 1.633044799651334e-07 -1.791547660104975e-07 ] [ 1.70593002193091e-08 8.803893400095589e-09 -2.014202934970625e-09 ] [ 1.24416337513583e-07 7.775599589968097e-08 3.251304642950155e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 103.92928 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.66513062632577e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.5466698 1.4656984 1.3851101 ] [ 1.7465591 1.1281482 4.1704838 ] [ 3.8576893 3.0931352 1.159448 ] [ 4.6186539 0.0452559 4.7876898 ] [ 4.4692219 3.0453131 3.9046142 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5466698e-10 1.4656984e-10 1.3851101e-10 ] [ 1.7465591e-10 1.1281482e-10 4.1704838e-10 ] [ 3.8576893e-10 3.0931352e-10 1.159448e-10 ] [ 4.6186539e-10 4.525590000000001e-12 4.7876898e-10 ] [ 4.4692219e-10 3.0453131e-10 3.9046142e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.7e-06 -9.8e-06 -2e-07 ] [ 2.92e-05 4.7e-06 2.4e-05 ] [ 2.35e-05 -2.21e-05 -1.6e-05 ] [ -2.42e-05 -7.5e-06 -4.21e-05 ] [ -2.19e-05 3.46e-05 3.43e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.073458335936e-14 -1.570133088384e-14 -3.2043532416e-16 ] [ 4.678355732736e-14 7.53023011776e-15 3.84522388992e-14 ] [ 3.76511505888e-14 -3.540810331968e-14 -2.56348259328e-14 ] [ -3.877267422336e-14 -1.2016324656e-14 -6.745163573568001e-14 ] [ -3.508766799552e-14 5.543531107968001e-14 5.495465809344e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.673165 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.870247205374083e-18 } }