{ "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" [ [ 2.70835 3.598 3.116557 ] [ 5.398567 2.472121 1.998263 ] [ 3.170959 1.761622 1.993892 ] [ 5.798068 2.225895 4.322659 ] [ 3.522139 1.857386 4.354431 ] [ 3.141461 3.938126 0.8725825 ] [ 4.820562 4.158888 3.263025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70835e-10 3.598e-10 3.116557e-10 ] [ 5.398567e-10 2.472121e-10 1.998263e-10 ] [ 3.170959e-10 1.761622e-10 1.993892e-10 ] [ 5.798068e-10 2.225895e-10 4.322659e-10 ] [ 3.522139e-10 1.857386e-10 4.354431e-10 ] [ 3.141461e-10 3.938126e-10 8.725825e-11 ] [ 4.820562e-10 4.158888e-10 3.263025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.9099871 7.0889104 4.7753046 ] [ 9.2763674 -3.8527154 -7.8975829 ] [ -2.6755291 -9.598777 -5.4287589 ] [ 2.8771835 -2.216993 3.586536 ] [ -3.9488094 -7.1312327 9.0103677 ] [ -2.4655318 3.508384 -6.843163 ] [ 5.8463065 12.2024237 2.7972965 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.427537302324959e-08 1.135768650982598e-08 7.650881387318696e-09 ] [ 1.486237897423128e-08 -6.172730540476121e-09 -1.265332268320986e-08 ] [ -4.286670172290065e-09 -1.537893609767276e-08 -8.697830589539924e-09 ] [ 4.609756137451518e-09 -3.552014353077255e-09 5.746264128857549e-09 ] [ -6.326690100675276e-09 -1.142549430942446e-08 1.443620047375147e-08 ] [ -3.950217407798941e-09 5.621050821588788e-09 -1.096395577092359e-08 ] [ 9.366815592331074e-09 1.955043796923583e-08 4.481763053745667e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.1651455 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.071122121530327e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.7211921 4.1714463 3.4581447 ] [ 5.8495784 1.7007477 1.7990482 ] [ 3.4931536 1.4123278 1.6182245 ] [ 5.634521 2.5042406 4.029915 ] [ 3.2868056 1.8681549 3.9987685 ] [ 2.5891989 3.5665668 1.1591634 ] [ 4.9856564 4.7885538 3.8581452 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7211921e-10 4.171446300000001e-10 3.4581447e-10 ] [ 5.849578400000001e-10 1.7007477e-10 1.7990482e-10 ] [ 3.4931536e-10 1.4123278e-10 1.6182245e-10 ] [ 5.634521000000001e-10 2.5042406e-10 4.029915e-10 ] [ 3.2868056e-10 1.8681549e-10 3.9987685e-10 ] [ 2.5891989e-10 3.5665668e-10 1.1591634e-10 ] [ 4.9856564e-10 4.7885538e-10 3.8581452e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.2e-06 2.1e-06 1e-07 ] [ -3.8e-06 -3.9e-06 3e-07 ] [ 6.9e-06 -2e-06 3.8e-06 ] [ -2.5e-06 2e-07 -2.8e-06 ] [ 6e-07 7.6e-06 -1.35e-05 ] [ -6.2e-06 -5.2e-06 4.3e-06 ] [ -4.2e-06 1.1e-06 7.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.474002491136e-14 3.36457090368e-15 1.6021766208e-16 ] [ -6.08827115904e-15 -6.24848882112e-15 4.8065298624e-16 ] [ 1.105501868352e-14 -3.2043532416e-15 6.08827115904e-15 ] [ -4.005441552e-15 3.2043532416e-16 -4.48609453824e-15 ] [ 9.6130597248e-16 1.217654231808e-14 -2.16293843808e-14 ] [ -9.93349504896e-15 -8.33131842816e-15 6.889359469440001e-15 ] [ -6.72914180736e-15 1.76239428288e-15 1.249697764224e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.040115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.929039076474339e-18 } }