{ "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" [ [ 1.152391 0.2084818 1.476287 ] [ 0.2004725 1.985654 1.37487 ] [ 0.8976264 2.29727 2.845471 ] [ 1.752289 1.001076 2.997864 ] [ 1.785348 1.533822 0.3428561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.152391e-10 2.084818e-11 1.476287e-10 ] [ 2.004725e-11 1.985654e-10 1.37487e-10 ] [ 8.976264000000001e-11 2.29727e-10 2.845471e-10 ] [ 1.752289e-10 1.001076e-10 2.997864e-10 ] [ 1.785348e-10 1.533822e-10 3.428561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -81.4167362 -173.2967181 -60.6029859 ] [ -320.0951317 -86.2382004 -534.9856273 ] [ -542.5425665 1346.0310259 415.0292732 ] [ 862.1966748 -1157.7911359 274.4561269 ] [ 81.8577597 71.2950284 -93.8967869 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.30443991281481e-07 -2.776519502011882e-07 -9.709668715965205e-08 ] [ -5.12848936441637e-07 -1.381688285007452e-07 -8.571414645240823e-07 ] [ -8.692490158351293e-07 2.156579440568419e-06 6.64950198468656e-07 ] [ 1.38139135489606e-06 -1.854985889708456e-06 4.39727189954498e-07 ] [ 1.311505888224044e-07 1.142272276817521e-07 -1.504392367394197e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 250.52845 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.013908254352618e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.68929 0.2113904 1.7534106 ] [ -0.2169842 1.9904132 0.7934304 ] [ 0.7959656 2.1943358 2.7530644 ] [ 2.5322352 0.8201084 2.8215086 ] [ 1.9876203 1.8100559 0.9159341 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.892899999999999e-11 2.113904e-11 1.7534106e-10 ] [ -2.169842e-11 1.9904132e-10 7.934304e-11 ] [ 7.959656e-11 2.1943358e-10 2.7530644e-10 ] [ 2.5322352e-10 8.201084e-11 2.8215086e-10 ] [ 1.9876203e-10 1.8100559e-10 9.159341e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.05e-05 1.12e-05 4.8e-06 ] [ 5.27e-05 -2.47e-05 4.28e-05 ] [ 2.5e-06 -6.7e-06 -3.3e-06 ] [ -6.43e-05 1.74e-05 -3.48e-05 ] [ -1.5e-06 2.8e-06 -9.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.68228545184e-14 1.794437815296e-14 7.69044777984e-15 ] [ 8.443470791616e-14 -3.957376253376001e-14 6.857315937023999e-14 ] [ 4.005441552e-15 -1.073458335936e-14 -5.28718284864e-15 ] [ -1.0301995671744e-13 2.787787320192e-14 -5.575574640383999e-14 ] [ -2.4032649312e-15 4.48609453824e-15 -1.506046023552e-14 ] ] } "relaxed-potential-energy" { "source-value" -28.867458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.625076630952593e-18 } }