{ "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" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5900199 1.9734814 2.9220705 ] [ 2.9948389 0.7789438 -0.0065647 ] [ -1.3873689 2.3054184 -1.4149825 ] [ -5.4391065 -0.0133014 -1.5601892 ] [ 0.85862 -1.4682224 0.007297 ] [ -0.2171209 -7.5787406 -5.9548313 ] [ 2.6001175 4.0024209 6.0072003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.45316089586754e-10 3.161865760663653e-09 4.681673039429366e-09 ] [ 4.798260868642389e-09 1.248005545277111e-09 -1.051780886256576e-11 ] [ -2.222810016005013e-09 3.693687461642143e-09 -2.267051880341136e-09 ] [ -8.714409272341316e-09 -2.131119210390912e-11 -2.499698660264655e-09 ] [ 1.375660890151296e-09 -2.352351603414866e-09 1.16910828019776e-11 ] [ -3.478660298670548e-10 -1.214248100442776e-08 -9.540691489668073e-09 ] [ 4.165847469832944e-09 6.412585192581294e-09 9.624595877122746e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.9296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.833944566509568e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2419703 2.9517878 1.3993855 ] [ 2.1979382 1.1893238 2.7858568 ] [ 1.5354403 3.3079363 3.7927839 ] [ 2.074022 5.0909384 2.220487 ] [ 3.6208126 2.2392036 4.4638458 ] [ 3.5361588 3.1407863 2.2008142 ] [ 3.5442458 4.6505369 4.1144202 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2419703e-10 2.9517878e-10 1.3993855e-10 ] [ 2.1979382e-10 1.1893238e-10 2.7858568e-10 ] [ 1.5354403e-10 3.3079363e-10 3.7927839e-10 ] [ 2.074022e-10 5.0909384e-10 2.220487e-10 ] [ 3.6208126e-10 2.2392036e-10 4.4638458e-10 ] [ 3.5361588e-10 3.1407863e-10 2.2008142e-10 ] [ 3.5442458e-10 4.6505369e-10 4.1144202e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.95e-05 3.47e-05 -4.39e-05 ] [ -9.2e-06 -6.76e-05 1.05e-05 ] [ -3.15e-05 -2.82e-05 8.6e-06 ] [ 3.44e-05 5.4e-05 -3.37e-05 ] [ 7.75e-05 1.8e-06 2.91e-05 ] [ -1.5e-06 -1.16e-05 1.07e-05 ] [ -2.02e-05 1.7e-05 1.87e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.930774272959999e-14 5.559552874176001e-14 -7.033555365312e-14 ] [ -1.474002491136e-14 -1.0830713956608e-13 1.68228545184e-14 ] [ -5.04685635552e-14 -4.518138070656001e-14 1.377871893888e-14 ] [ 5.511487575552001e-14 8.65175375232e-14 -5.399335212096e-14 ] [ 1.24168688112e-13 2.88391791744e-15 4.662333966527999e-14 ] [ -2.4032649312e-15 -1.858524880128e-14 1.714328984256e-14 ] [ -3.236396774016e-14 2.72370025536e-14 2.996070280896e-14 ] ] } "relaxed-potential-energy" { "source-value" -31.275942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.010958306589679e-18 } }