{ "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" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.774625 -0.6764144 -8.2696888 ] [ -5.9579484 -1.5938595 14.4463582 ] [ -2.6031231 -5.0987411 0.5598411 ] [ -8.6485859 -12.4623235 3.3027947 ] [ 8.4491565 3.6159728 -15.0112363 ] [ -0.5951724 14.9896781 -3.4213147 ] [ 16.1302982 1.2256875 8.3932458 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.08541457896872e-08 -1.08373533765246e-09 -1.324950205665161e-08 ] [ -9.545685634412767e-09 -2.553644427739978e-09 2.314561736374237e-08 ] [ -4.17066297188442e-09 -8.169083785932075e-09 8.969643217829548e-10 ] [ -1.385656213196053e-08 -1.996684335254643e-08 5.29166045164215e-09 ] [ 1.353704100978036e-08 5.793427081608715e-09 -2.40506518491643e-08 ] [ -9.535713046254261e-10 2.401611180513777e-08 -5.481550424739365e-09 ] [ 2.584358666257232e-08 1.9637678569068e-09 1.344746219338779e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -15.810587 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.533135285252441e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8169698 2.5668302 1.1087564 ] [ 2.7824426 3.2337742 5.2403217 ] [ 1.1205012 3.380833 3.3554866 ] [ 3.0259128 1.7189897 3.2405919 ] [ 4.1485686 3.2860006 1.6005703 ] [ 3.1549542 4.8241412 3.2954417 ] [ 4.9514829 3.165837 3.9832485 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8169698e-10 2.5668302e-10 1.1087564e-10 ] [ 2.7824426e-10 3.2337742e-10 5.2403217e-10 ] [ 1.1205012e-10 3.380833e-10 3.3554866e-10 ] [ 3.0259128e-10 1.7189897e-10 3.2405919e-10 ] [ 4.1485686e-10 3.2860006e-10 1.6005703e-10 ] [ 3.1549542e-10 4.824141199999999e-10 3.2954417e-10 ] [ 4.9514829e-10 3.165837e-10 3.9832485e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.86e-05 -3.48e-05 -3.03e-05 ] [ 1.34e-05 -1.37e-05 -0.0001651 ] [ 6.16e-05 1.72e-05 1.21e-05 ] [ -4.7e-06 7.07e-05 2.78e-05 ] [ -9.7e-06 -3.06e-05 1.11e-05 ] [ -5.58e-05 -5e-07 7.38e-05 ] [ 5.37e-05 -8.2e-06 7.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.388754997888e-14 -5.575574640383999e-14 -4.854595161024e-14 ] [ 2.146916671872e-14 -2.194981970496e-14 -2.6451936009408e-13 ] [ 9.869407984128002e-14 2.755743787776e-14 1.938633711168e-14 ] [ -7.53023011776e-15 1.1327388709056e-13 4.454051005824e-14 ] [ -1.554111322176e-14 -4.902660459647999e-14 1.778416049088e-14 ] [ -8.940145544064e-14 -8.010883104e-16 1.1824063461504e-13 ] [ 8.603688453696e-14 -1.313784829056e-14 1.1311366942848e-13 ] ] } "relaxed-potential-energy" { "source-value" -27.211343 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.359737757516974e-18 } }