{ "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" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.5013651 -1.0575222 -2.4491241 ] [ 1.2346793 -4.4429065 -1.6012709 ] [ 0.8239752 -1.3248244 3.2871155 ] [ -6.9555056 4.1370741 3.3750551 ] [ 4.0613477 -3.189234 -10.5971144 ] [ 1.8765204 8.9158471 -0.539824 ] [ 4.4603482 -3.038434 8.5251628 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.814158545705054e-09 -1.694337344816982e-09 -3.923929374457841e-09 ] [ 1.97817430864571e-09 -7.118320922700356e-09 -2.565518799547375e-09 ] [ 1.320153801559004e-09 -2.122602680345388e-09 5.266539603969302e-09 ] [ -1.114394845816348e-08 6.628323401537202e-09 5.407434375131806e-09 ] [ 6.506996333879852e-09 -5.109716153060467e-09 -1.697844893962302e-08 ] [ 3.006517113334264e-09 1.428476177824748e-08 -8.648933921467392e-10 ] [ 7.146265606667363e-09 -4.868107918643828e-09 1.365881652667387e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -14.133358 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.264413576099665e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.556763 3.2075815 1.8524151 ] [ 2.5153717 1.9020417 2.031649 ] [ 2.4516549 2.7046385 4.3822847 ] [ 1.1497655 4.6732074 3.6054143 ] [ 4.1427158 3.5738047 1.520998 ] [ 3.1421959 5.6041521 2.6740969 ] [ 4.4766939 3.9329641 3.9764839 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.567630000000001e-11 3.2075815e-10 1.8524151e-10 ] [ 2.515371700000001e-10 1.9020417e-10 2.031649e-10 ] [ 2.4516549e-10 2.7046385e-10 4.3822847e-10 ] [ 1.1497655e-10 4.6732074e-10 3.6054143e-10 ] [ 4.142715800000001e-10 3.5738047e-10 1.520998e-10 ] [ 3.1421959e-10 5.604152100000001e-10 2.6740969e-10 ] [ 4.4766939e-10 3.9329641e-10 3.9764839e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.9e-06 1.14e-05 -7e-07 ] [ -3.7e-06 1.86e-05 -9.5e-06 ] [ 1.57e-05 1.38e-05 -2.11e-05 ] [ 1.2e-05 -1.74e-05 -7e-06 ] [ -1.74e-05 -2e-05 2.73e-05 ] [ -4.2e-06 -3.3e-05 7.8e-06 ] [ 2.5e-06 2.67e-05 3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.850665441919999e-15 1.826481347712e-14 -1.12152363456e-15 ] [ -5.928053496960001e-15 2.980048514688e-14 -1.52206778976e-14 ] [ 2.515417294656e-14 2.211003736704e-14 -3.380592669888e-14 ] [ 1.92261194496e-14 -2.787787320192e-14 -1.12152363456e-14 ] [ -2.787787320192e-14 -3.2043532416e-14 4.373942174784e-14 ] [ -6.72914180736e-15 -5.28718284864e-14 1.249697764224e-14 ] [ 4.005441552e-15 4.277811577536e-14 5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.439394 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.11453425893198e-18 } }