{ "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" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 7.2586945 -5.0118524 7.3751633 ] [ -8.5996542 1.2098274 5.6132454 ] [ 1.2479101 8.746904 -4.6237387 ] [ 3.981605 -0.8419738 -2.384107 ] [ -4.3026467 -9.0782001 -6.6194692 ] [ -1.1404765 -0.5168428 -0.7548315 ] [ 1.5545678 5.4921377 1.3937376 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.162971062542955e-08 -8.029872742180372e-09 1.181631421384218e-08 ] [ -1.377816490620453e-08 1.93835717548325e-09 8.993410546693145e-09 ] [ 1.99937238708019e-09 1.4014085093182e-08 -7.408046045828185e-09 ] [ 6.379234444260384e-09 -1.348990737686135e-09 -3.819760496885626e-09 ] [ -6.893599950302273e-09 -1.454487995916422e-08 -1.060555879434568e-08 ] [ -1.827244784871811e-09 -8.280734507888104e-10 -1.209373381943395e-09 ] [ 2.49069218460849e-09 8.799374621154284e-09 2.233013798249902e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.577088 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.457030593854423e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4281723 1.2443078 2.5986724 ] [ 1.8848477 3.1800132 4.090799 ] [ 2.7906774 3.6395362 1.8001968 ] [ 4.7788613 2.1265648 2.0348267 ] [ 4.0498367 1.8837625 4.4243368 ] [ 4.0143314 5.4913412 2.6376151 ] [ 4.0759633 4.3504213 4.6784141 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4281723e-10 1.2443078e-10 2.5986724e-10 ] [ 1.8848477e-10 3.1800132e-10 4.090799e-10 ] [ 2.7906774e-10 3.6395362e-10 1.8001968e-10 ] [ 4.7788613e-10 2.1265648e-10 2.0348267e-10 ] [ 4.0498367e-10 1.8837625e-10 4.4243368e-10 ] [ 4.0143314e-10 5.4913412e-10 2.6376151e-10 ] [ 4.0759633e-10 4.3504213e-10 4.678414100000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.92e-05 -2.17e-05 5.23e-05 ] [ 8.03e-05 6.75e-05 2.21e-05 ] [ -6.7e-06 3.7e-05 3.6e-06 ] [ 6.59e-05 -6.35e-05 -3.8e-05 ] [ -6.71e-05 4.38e-05 -5.25e-05 ] [ -3.86e-05 -7.1e-06 4.12e-05 ] [ -6.3e-05 -5.6e-05 -2.86e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.678355732736e-14 -3.476723267136e-14 8.379383726784e-14 ] [ 1.2865478265024e-13 1.08146921904e-13 3.540810331968e-14 ] [ -1.073458335936e-14 5.92805349696e-14 5.76783583488e-15 ] [ 1.0558343931072e-13 -1.017382154208e-13 -6.08827115904e-14 ] [ -1.0750605125568e-13 7.017533599104001e-14 -8.4114272592e-14 ] [ -6.184401756288e-14 -1.137545400768e-14 6.600967677696001e-14 ] [ -1.009371271104e-13 -8.97218907648e-14 -4.582225135488e-14 ] ] } "relaxed-potential-energy" { "source-value" -25.483692 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.082937553406799e-18 } }