{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.883493 0.9166533 2.516283 ] [ 2.817177 3.567551 2.605543 ] [ 5.326989 2.981775 0.9718155 ] [ 4.378062 1.631795 2.957356 ] [ 3.2217 2.222093 1.004364 ] [ 4.317932 5.197679 1.168278 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.883493e-10 9.166533e-11 2.516283e-10 ] [ 2.817177e-10 3.567551e-10 2.605543e-10 ] [ 5.326989e-10 2.981775e-10 9.718155000000001e-11 ] [ 4.378062e-10 1.631795e-10 2.957356e-10 ] [ 3.2217e-10 2.222093e-10 1.004364e-10 ] [ 4.317932e-10 5.197679e-10 1.168278e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.7365681 2.6364641 -3.2288441 ] [ -1.1351972 1.8961386 2.0638345 ] [ -3.649731 3.9213925 -0.120116 ] [ -0.907348 0.2211763 -1.5191311 ] [ 0.7893497 -4.0165899 3.2191206 ] [ 2.1663584 -4.6585815 -0.4148639 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.384465431047076e-09 4.224081142598513e-09 -5.173178529228018e-09 ] [ -1.818786413837622e-09 3.037948934716443e-09 3.306627385100458e-09 ] [ -5.847513680409005e-09 6.282763384480464e-09 -1.924470469840128e-10 ] [ -1.453731752529639e-09 3.54363496935047e-10 -2.433916332350187e-09 ] [ 1.264677634975494e-09 -6.435286433121409e-09 5.157599764855669e-09 ] [ 3.470888780753695e-09 -7.463870365391397e-09 -6.646852413939091e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.1981589 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.328368660783446e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1189354 0.8322772 1.0866517 ] [ 1.926521 3.4592536 3.5666779 ] [ 4.4070506 3.6313988 0.9415945 ] [ 4.7267601 1.1681412 3.5711391 ] [ 3.2938024 2.2710148 2.2925805 ] [ 5.4722835 5.1554607 -0.2350042 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1189354e-10 8.322772000000001e-11 1.0866517e-10 ] [ 1.926521e-10 3.4592536e-10 3.566677900000001e-10 ] [ 4.4070506e-10 3.6313988e-10 9.415945000000001e-11 ] [ 4.7267601e-10 1.1681412e-10 3.5711391e-10 ] [ 3.2938024e-10 2.2710148e-10 2.2925805e-10 ] [ 5.4722835e-10 5.1554607e-10 -2.350042e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0007183 0.0007201 0.0001571 ] [ 0.0009065 -0.0014199 -0.0008399 ] [ -0.001936 -0.0021183 0.0025022 ] [ 0.0017838 -0.0014494 0.0014456 ] [ -0.0026472 0.0032712 -0.0016103 ] [ 0.0011746 0.0009963 -0.0016547 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.15084346672064e-12 1.15372738463808e-12 2.5170194712768e-13 ] [ 1.4523731067552e-12 -2.27493058387392e-12 -1.34566814380992e-12 ] [ -3.1018139378688e-12 -3.39389073584064e-12 4.00896634056576e-12 ] [ 2.857962656183041e-12 -2.32219479418752e-12 2.31610652302848e-12 ] [ -4.241281950581761e-12 5.24104016196096e-12 -2.57998501247424e-12 ] [ 1.88191665879168e-12 1.59624856730304e-12 -2.65112165443776e-12 ] ] } "relaxed-potential-energy" { "source-value" -11.182996 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.791713474169992e-18 } }