{ "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" [ [ 0.0221122 0.00357 0.1110342 ] [ 0.2725629 2.182164 0.260904 ] [ 0.3472204 2.881652 2.59775 ] [ 1.734388 0.2655593 2.566686 ] [ 2.338795 2.363947 0.0295877 ] [ 1.600298 1.908592 1.497057 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.21122e-12 3.57e-13 1.110342e-11 ] [ 2.725629e-11 2.182164e-10 2.60904e-11 ] [ 3.472204e-11 2.881652e-10 2.59775e-10 ] [ 1.734388e-10 2.655593e-11 2.566686e-10 ] [ 2.338795e-10 2.363947e-10 2.95877e-12 ] [ 1.600298e-10 1.908592e-10 1.497057e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6233497 -1.3231901 0.8051652 ] [ -14.7544299 3.0713473 -8.6003519 ] [ -4.6321167 3.8386948 4.7436093 ] [ -0.0886906 -4.995728 2.6219194 ] [ 12.4732977 4.8260646 -14.4598837 ] [ 6.3785899 -5.4171886 14.8895416 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.987163159226938e-10 -2.119984243094014e-09 1.290016859321756e-09 ] [ -2.363920263901248e-08 4.920840838417204e-09 -1.377928274483286e-08 ] [ -7.421469081557248e-09 6.150267062946532e-09 7.600099918669454e-09 ] [ -1.420980058047245e-10 -8.004038605475943e-09 4.200777964301964e-09 ] [ 1.998442595921841e-08 7.732207872590503e-09 -2.3167287603627e-08 ] [ 1.021962761145101e-08 -8.679292925384284e-09 2.385567544594902e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 3.9168980695093207 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.275562513024488e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3539565 0.2613243 0.2163266 ] [ -0.4676849 1.7528521 0.4884624 ] [ 0.7511633 2.9405074 2.1380066 ] [ 0.4149417 0.6054443 2.3650397 ] [ 1.6901902 2.5963884 -0.010693 ] [ 2.5728098 1.4489678 1.8658766 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3539565e-10 2.613243e-11 2.163266e-11 ] [ -4.676849e-11 1.7528521e-10 4.884624000000001e-11 ] [ 7.511633e-11 2.9405074e-10 2.1380066e-10 ] [ 4.149417000000001e-11 6.054443e-11 2.3650397e-10 ] [ 1.6901902e-10 2.5963884e-10 -1.0693e-12 ] [ 2.5728098e-10 1.4489678e-10 1.8658766e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.56e-05 -2.41e-05 1.18e-05 ] [ -1.44e-05 2.59e-05 -7.7e-06 ] [ 1.82e-05 8e-07 2.01e-05 ] [ -2.41e-05 -2.86e-05 -6.7e-06 ] [ -1.38e-05 2.5e-06 -2.95e-05 ] [ 1.85e-05 2.35e-05 1.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.499395528448e-14 -3.861245656128e-14 1.890568412544e-14 ] [ -2.307134333952e-14 4.149637447872e-14 -1.233675998016e-14 ] [ 2.915961449856e-14 1.28174129664e-15 3.220375007808e-14 ] [ -3.861245656128e-14 -4.582225135488e-14 -1.073458335936e-14 ] [ -2.211003736704e-14 4.005441552e-15 -4.72642103136e-14 ] [ 2.96402674848e-14 3.76511505888e-14 1.92261194496e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.32264193049068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.333434232432195e-18 } }