{ "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" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2714479 -2.9649582 -1.2609044 ] [ -2.9725134 2.4837984 3.0405163 ] [ -1.8346924 0.0984019 0.0571092 ] [ 2.8877368 -0.8530839 -1.0370007 ] [ 3.0269718 -2.9656124 1.6738413 ] [ 0.5735714 -0.4653042 -5.3626568 ] [ 1.5903736 4.6667584 2.8890952 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.241437341545256e-09 -4.75038670968925e-09 -2.020191550743852e-09 ] [ -4.762491474494719e-09 3.979483727260447e-09 4.871444131021319e-09 ] [ -2.939501269639442e-09 1.576572236222995e-10 9.149902507259136e-11 ] [ 4.626664387983806e-09 -1.366791080160885e-09 -1.661458277293235e-09 ] [ 4.849743449780894e-09 -4.751434853634578e-09 2.681789397789479e-09 ] [ 9.189626874395251e-10 -7.454995108000474e-10 -8.591923350334141e-09 ] [ 2.548059400257531e-09 7.476971203402016e-09 4.6288407847055e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.301737 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.573132162463033e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0769087 1.4026067 2.8760215 ] [ 2.0431491 3.2332236 4.4715075 ] [ 1.6553502 3.6583097 2.1121122 ] [ 4.2066269 1.4821442 1.8186348 ] [ 4.211355 2.2103754 4.0835292 ] [ 3.7979398 3.6689557 1.0780781 ] [ 3.7898752 4.4660897 3.3196318 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0769087e-10 1.4026067e-10 2.8760215e-10 ] [ 2.0431491e-10 3.2332236e-10 4.4715075e-10 ] [ 1.6553502e-10 3.6583097e-10 2.1121122e-10 ] [ 4.2066269e-10 1.4821442e-10 1.8186348e-10 ] [ 4.211355e-10 2.2103754e-10 4.0835292e-10 ] [ 3.7979398e-10 3.6689557e-10 1.0780781e-10 ] [ 3.7898752e-10 4.4660897e-10 3.3196318e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.65e-05 6.8e-06 -7.9e-06 ] [ 9.1e-06 7e-07 -4.05e-05 ] [ 4.5e-06 -1.36e-05 5.11e-05 ] [ -1.48e-05 1.94e-05 -1.8e-06 ] [ 1.54e-05 -1.22e-05 -3.2e-06 ] [ 3.26e-05 -2.95e-05 4.6e-06 ] [ -3.04e-05 2.85e-05 -2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.64359142432e-14 1.089480102144e-14 -1.265719530432e-14 ] [ 1.457980724928e-14 1.12152363456e-15 -6.488815314240001e-14 ] [ 7.2097947936e-15 -2.178960204288e-14 8.187122532288001e-14 ] [ -2.371221398784e-14 3.108222644352e-14 -2.88391791744e-15 ] [ 2.467351996032e-14 -1.954655477376e-14 -5.126965186560001e-15 ] [ 5.223095783807999e-14 -4.72642103136e-14 7.370012455680001e-15 ] [ -4.870616927232e-14 4.56620336928e-14 -3.52478856576e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.628085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.945854200207517e-18 } }