{ "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" [ [ 2.019678 3.528357 2.55152 ] [ 4.681874 1.030316 1.978031 ] [ 3.876194 2.698932 0.9098523 ] [ 3.736168 1.84025 3.911189 ] [ 5.498325 3.105138 2.775129 ] [ 3.884183 4.867643 2.227305 ] [ 3.327521 4.019973 4.190113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.019678e-10 3.528357e-10 2.55152e-10 ] [ 4.681874e-10 1.030316e-10 1.978031e-10 ] [ 3.876194e-10 2.698932e-10 9.098523e-11 ] [ 3.736168e-10 1.84025e-10 3.911189e-10 ] [ 5.498325e-10 3.105138e-10 2.775129000000001e-10 ] [ 3.884183e-10 4.867643e-10 2.227305e-10 ] [ 3.327521e-10 4.019973e-10 4.190113e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5219739 -1.9445351 -1.5971818 ] [ 0.7792231 -1.5746787 0.5676732 ] [ -1.4164319 2.4022424 -0.9830636 ] [ -1.0929554 -2.2514449 1.0369706 ] [ 0.8511596 0.4539128 0.5698522 ] [ 1.0263822 1.7419076 -2.6528939 ] [ 1.3745964 1.172596 3.0586433 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.438471000047797e-09 -3.11548867554499e-09 -2.558967339127262e-09 ] [ 1.2484530332073e-09 -2.522913398411737e-09 9.095127292947225e-10 ] [ -2.269374075135324e-09 3.848816610774482e-09 -1.575041516679483e-09 ] [ -1.751107589457112e-09 -3.607212381799394e-09 1.661410051776949e-09 ] [ 1.36370801168948e-09 7.272484760418662e-10 9.130038721514458e-10 ] [ 1.64444556484527e-09 2.790843632313838e-09 -4.250404584042933e-09 ] [ 2.202346215115845e-09 1.878705896843597e-09 4.90048678662656e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -30.735025 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.924293849470352e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0034555 3.3018797 2.5453168 ] [ 4.7383047 1.1178739 2.0564175 ] [ 3.8106693 2.9086323 0.7813641 ] [ 3.4521995 1.747034 3.9651509 ] [ 5.5027801 3.154779 2.8857211 ] [ 3.8808888 4.8274519 2.0657691 ] [ 3.6356451 4.0329581 4.2433998 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0034555e-10 3.3018797e-10 2.5453168e-10 ] [ 4.738304699999999e-10 1.1178739e-10 2.0564175e-10 ] [ 3.8106693e-10 2.9086323e-10 7.813641000000001e-11 ] [ 3.4521995e-10 1.747034e-10 3.9651509e-10 ] [ 5.5027801e-10 3.154779e-10 2.8857211e-10 ] [ 3.8808888e-10 4.8274519e-10 2.0657691e-10 ] [ 3.6356451e-10 4.0329581e-10 4.2433998e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.24e-05 1.39e-05 2.93e-05 ] [ 2.59e-05 -7.89e-05 5.24e-05 ] [ 3.77e-05 1.44e-05 -1.27e-05 ] [ -7.2e-06 2.9e-06 -5.51e-05 ] [ -3.01e-05 3.69e-05 -6.08e-05 ] [ 2.8e-06 -1.25e-05 7.04e-05 ] [ 1.33e-05 2.33e-05 -2.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.793228872192001e-14 2.227025502912e-14 4.694377498944e-14 ] [ 4.149637447872e-14 -1.2641173538112e-13 8.395405492992e-14 ] [ 6.040205860416e-14 2.307134333952e-14 -2.034764308416e-14 ] [ -1.153567166976e-14 4.646312200320001e-15 -8.827993180608e-14 ] [ -4.822551628608e-14 5.912031730752001e-14 -9.741233854464e-14 ] [ 4.48609453824e-15 -2.002720776e-14 1.1279323410432e-13 ] [ 2.130894905664e-14 3.733071526464e-14 -3.76511505888e-14 ] ] } "relaxed-potential-energy" { "source-value" -32.196266 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.158410466225794e-18 } }