{ "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" [ [ 0.0409962 0.6822116 1.595736 ] [ 0.3790876 1.575629 0.6188876 ] [ 0.3154214 2.976467 2.437822 ] [ 1.63698 0.1180447 0.631717 ] [ 1.584423 0.2949968 2.813326 ] [ 2.305753 1.803926 1.00695 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.099619999999999e-12 6.822116000000001e-11 1.595736e-10 ] [ 3.790876e-11 1.575629e-10 6.188876e-11 ] [ 3.154214e-11 2.976467e-10 2.437822e-10 ] [ 1.63698e-10 1.180447e-11 6.31717e-11 ] [ 1.584423e-10 2.949968e-11 2.813326e-10 ] [ 2.305753e-10 1.803926e-10 1.00695e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -25.644348 -37.9356443 40.7521258 ] [ 3.9564112 41.5285994 -46.3623814 ] [ -2.508749 5.5144809 2.7798841 ] [ 5.8975952 -10.4023398 -5.4783113 ] [ 5.5994025 -6.4389227 10.3758472 ] [ 12.6996881 7.7338264 -2.0671645 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.108677482125924e-08 -6.077960239244478e-08 6.52921032046605e-08 ] [ 6.338869526911273e-09 6.653615105324891e-08 -7.428072356369277e-08 ] [ -4.019458995255379e-09 8.835172373828142e-09 4.453865313553649e-09 ] [ 9.4489891483823e-09 -1.666638562917735e-08 -8.777222286324456e-09 ] [ 8.971231775949071e-09 -1.031629141307841e-08 1.662393980483314e-08 ] [ 2.034714336527197e-08 1.239095584740583e-08 -3.311962633247722e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 11.193043 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.793323181020909e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0044588 -0.1368993 1.4049554 ] [ -0.716137 2.1460032 0.8662089 ] [ 1.2246721 2.8277238 2.1991939 ] [ 2.0732496 -0.1829363 0.2622489 ] [ 0.7224933 0.8346303 3.5347545 ] [ 2.9628421 1.9627534 0.8370769 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.4588e-13 -1.368993e-11 1.4049554e-10 ] [ -7.16137e-11 2.1460032e-10 8.662089e-11 ] [ 1.2246721e-10 2.8277238e-10 2.1991939e-10 ] [ 2.0732496e-10 -1.829363e-11 2.622489e-11 ] [ 7.224933e-11 8.346303e-11 3.5347545e-10 ] [ 2.9628421e-10 1.9627534e-10 8.370769e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.2e-06 2.05e-05 2.38e-05 ] [ 6.1e-06 -3.39e-05 -7.4e-06 ] [ 2.09e-05 1.51e-05 -1.4e-06 ] [ 8.9e-06 5.16e-05 -1e-07 ] [ -1.74e-05 -1.74e-05 -6.4e-06 ] [ -1.33e-05 -3.6e-05 -8.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.33131842816e-15 3.28446207264e-14 3.813180357504e-14 ] [ 9.77327738688e-15 -5.431378744512e-14 -1.185610699392e-14 ] [ 3.348549137472e-14 2.419286697408e-14 -2.24304726912e-15 ] [ 1.425937192512e-14 8.267231363328e-14 -1.6021766208e-16 ] [ -2.787787320192e-14 -2.787787320192e-14 -1.025393037312e-14 ] [ -2.130894905664e-14 -5.76783583488e-14 -1.36185012768e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.186062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.753510674001929e-18 } }