{ "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" [ [ 0.09862 0.3102875 1.608695 ] [ 0.216089 2.435481 0.8089597 ] [ 1.587261 0.9923217 0.3598848 ] [ 2.442881 2.780277 0.9615339 ] [ 1.769015 1.574471 2.844855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.862e-12 3.102875e-11 1.608695e-10 ] [ 2.16089e-11 2.435481e-10 8.089597e-11 ] [ 1.587261e-10 9.923217e-11 3.598848e-11 ] [ 2.442881e-10 2.780277e-10 9.615339e-11 ] [ 1.769015e-10 1.574471e-10 2.844855e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.1058051 -32.9443796 17.1614292 ] [ -36.1337914 29.6995312 -11.9433763 ] [ 9.4495008 -12.0455813 -15.5084401 ] [ 36.8456074 15.9639563 2.5521333 ] [ 0.9444883 -0.6735266 7.7382539 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.77934612863814e-08 -5.278271478188045e-08 2.749564064375445e-08 ] [ -5.789271580194411e-08 4.758389453736017e-08 -1.913539828127681e-08 ] [ 1.513976925999089e-08 -1.929914874280567e-08 -2.484726015329721e-08 ] [ 5.903317075545548e-08 2.557707755933287e-08 4.088968306425153e-09 ] [ 1.513237072879137e-09 -1.079108572006913e-09 1.239804948439442e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 3.385858 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.424742528948647e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2798791 0.048733 1.7741219 ] [ 0.0180462 2.6564108 0.9325738 ] [ 1.6025094 0.8008532 -0.3414448 ] [ 2.7680309 2.6694806 1.0515555 ] [ 1.4454004 1.9173606 3.167122 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.798791e-11 4.8733e-12 1.7741219e-10 ] [ 1.80462e-12 2.6564108e-10 9.325738000000001e-11 ] [ 1.6025094e-10 8.008532e-11 -3.414448e-11 ] [ 2.7680309e-10 2.6694806e-10 1.0515555e-10 ] [ 1.4454004e-10 1.9173606e-10 3.167122e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.4e-06 -1e-06 2e-07 ] [ -1e-07 -2e-07 -0.0 ] [ 2e-07 -1e-06 -2.5e-06 ] [ 1.6e-06 1.7e-06 -9e-07 ] [ -3e-07 5e-07 3.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.24304726912e-15 -1.6021766208e-15 3.2043532416e-16 ] [ -1.6021766208e-16 -3.2043532416e-16 0.0 ] [ 3.2043532416e-16 -1.6021766208e-15 -4.005441552e-15 ] [ 2.56348259328e-15 2.72370025536e-15 -1.44195895872e-15 ] [ -4.8065298624e-16 8.010883104e-16 5.28718284864e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.98496 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.561072919642317e-18 } }