{ "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" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2858391 1.0003017 -0.137244 ] [ -2.1393365 -0.6079661 4.7443415 ] [ 5.060125 -1.9924451 -2.9046976 ] [ 0.8722513 2.0400981 -1.3923 ] [ -2.5072007 -0.4399887 -0.3100999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.060141344130514e-09 1.602659997486496e-09 -2.198891281450752e-10 ] [ -3.4275949243241e-09 -9.740690716589549e-10 7.601273032391204e-09 ] [ 8.1072139733256e-09 -3.192248957447518e-09 -4.65383858521387e-09 ] [ 1.397500640322407e-09 3.2685974799585e-09 -2.23071050913984e-09 ] [ -4.016978345193394e-09 -7.049396085561851e-10 -4.96834809892418e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.527052 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.167272646274588e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6883834 1.7316625 0.4656044 ] [ 1.7545924 1.7855446 2.7199829 ] [ 3.1406743 1.2882277 0.5731378 ] [ 2.1721125 3.6711833 0.974264 ] [ 4.0232034 2.7649748 2.3793187 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.883834e-11 1.7316625e-10 4.656044e-11 ] [ 1.7545924e-10 1.7855446e-10 2.7199829e-10 ] [ 3.1406743e-10 1.2882277e-10 5.731378e-11 ] [ 2.1721125e-10 3.6711833e-10 9.742640000000001e-11 ] [ 4.0232034e-10 2.7649748e-10 2.3793187e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-07 -6e-07 -1.3e-06 ] [ 5.6e-06 2.6e-06 -1.6e-06 ] [ -1.4e-06 3.4e-06 2.8e-06 ] [ 3.2e-06 -3.6e-06 2.4e-06 ] [ -6.9e-06 -1.8e-06 -2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-16 -9.6130597248e-16 -2.08282960704e-15 ] [ 8.972189076479999e-15 4.16565921408e-15 -2.56348259328e-15 ] [ -2.24304726912e-15 5.44740051072e-15 4.48609453824e-15 ] [ 5.126965186560001e-15 -5.76783583488e-15 3.84522388992e-15 ] [ -1.105501868352e-14 -2.88391791744e-15 -3.68500622784e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }