{ "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" [ [ 1.825241 1.571351 1.750599 ] [ 0.5622357 3.903382 1.066374 ] [ 3.055372 3.197946 1.429481 ] [ 3.763641 1.041333 1.110804 ] [ 3.309317 1.461591 3.355414 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.825241e-10 1.571351e-10 1.750599e-10 ] [ 5.622357e-11 3.903382e-10 1.066374e-10 ] [ 3.055372e-10 3.197946e-10 1.429481e-10 ] [ 3.763641e-10 1.041333e-10 1.110804e-10 ] [ 3.309317e-10 1.461591e-10 3.355414e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.60625 -3.0910121 0.7487426 ] [ 0.0 0.0 0.0 ] [ 1.8687772 10.668225 -0.7982842 ] [ 8.7076295 -7.8504476 -7.9459095 ] [ 1.0298432 0.2732347 7.9954512 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.859526240516e-08 -4.952347321229912e-09 1.199617888717006e-09 ] [ 0.0 0.0 0.0 ] [ 2.994111139324086e-09 1.709238068043408e-08 -1.278992281994031e-09 ] [ 1.395116040748839e-08 -1.257780360753547e-08 -1.273075043189262e-08 ] [ 1.649990698129858e-09 4.377702483313018e-10 1.281012498538731e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.7057252 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.335049657749404e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.2206398 1.7032661 1.9856894 ] [ 0.3032081 4.5077558 0.8505125 ] [ 2.2271958 3.5508637 1.314573 ] [ 3.8325235 0.2374553 0.4538006 ] [ 2.9322395 1.1762621 4.1080965 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.2206398e-10 1.7032661e-10 1.9856894e-10 ] [ 3.032081e-11 4.5077558e-10 8.505125e-11 ] [ 2.2271958e-10 3.5508637e-10 1.314573e-10 ] [ 3.8325235e-10 2.374553e-11 4.538006e-11 ] [ 2.9322395e-10 1.1762621e-10 4.1080965e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0087301 -0.6650552 0.0254794 ] [ -0.0600296 0.1462786 -0.0515947 ] [ -0.1794371 0.3637248 -0.1355609 ] [ 0.0664142 0.1654877 0.2188403 ] [ 0.1643224 -0.0104359 -0.0571639 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.398716211724608e-11 -1.065535892981468e-09 4.082249899201152e-11 ] [ -9.617802167597568e-11 2.343641530433549e-10 -8.266382209718977e-11 ] [ -2.874899265241517e-10 5.827513709651559e-10 -2.171925046746068e-10 ] [ 1.064072785291354e-10 2.651405239699641e-10 3.506208123488582e-10 ] [ 2.632735075537459e-10 -1.672015499700672e-11 -9.158666413374911e-11 ] ] } "relaxed-potential-energy" { "source-value" -10.185606 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.631913980188021e-18 } }