{ "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" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7434995 0.7793901 1.1189427 ] [ 0.3764467 -0.524076 -0.5242217 ] [ -1.8910003 1.1137924 0.5549495 ] [ -4.8858965 1.0463243 -1.4210047 ] [ 1.4400477 -1.2234538 0.9815357 ] [ 1.4567121 -4.7097117 -5.3920333 ] [ 2.7601908 3.5177347 4.6818318 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.19121751647649e-09 1.248720596702974e-09 1.792743833954828e-09 ] [ 6.031341017173114e-10 -8.396623147223809e-10 -8.398957518560314e-10 ] [ -3.029716470585787e-09 1.784492143704722e-09 8.891271146246496e-10 ] [ -7.828069143948549e-09 1.676396331234925e-09 -2.276700508386917e-09 ] [ 2.307210757776812e-09 -1.960189074988919e-09 1.572593551020563e-09 ] [ 2.333910069856472e-09 -7.545789976448224e-09 -8.638989691835073e-09 ] [ 4.422313168707249e-09 5.636032294516902e-09 7.501121452477982e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.164970085572456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.147954755983556e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3318631 2.9745263 1.4838188 ] [ 2.2561246 1.309595 2.7591921 ] [ 1.403103 3.279077 3.8890926 ] [ 2.0713993 4.9847143 2.2993315 ] [ 3.5668816 2.2908065 4.3629323 ] [ 3.6684953 3.1696402 2.104507 ] [ 3.4527212 4.5621537 4.078719 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3318631e-10 2.9745263e-10 1.4838188e-10 ] [ 2.2561246e-10 1.309595e-10 2.7591921e-10 ] [ 1.403103e-10 3.279077e-10 3.8890926e-10 ] [ 2.0713993e-10 4.9847143e-10 2.2993315e-10 ] [ 3.5668816e-10 2.2908065e-10 4.3629323e-10 ] [ 3.6684953e-10 3.1696402e-10 2.104507e-10 ] [ 3.4527212e-10 4.5621537e-10 4.078719e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.1e-06 -3.2e-06 -7.3e-06 ] [ 1.02e-05 9.8e-06 1.45e-05 ] [ -8.2e-06 -1.6e-06 -9.2e-06 ] [ -7.5e-06 2.19e-05 -1.6e-05 ] [ 1.52e-05 -3.86e-05 9.6e-06 ] [ -1.41e-05 -4.9e-06 -5.3e-06 ] [ 6.5e-06 1.65e-05 1.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.36457090368e-15 -5.126965186560001e-15 -1.169588933184e-14 ] [ 1.634220153216e-14 1.570133088384e-14 2.32315610016e-14 ] [ -1.313784829056e-14 -2.56348259328e-15 -1.474002491136e-14 ] [ -1.2016324656e-14 3.508766799552e-14 -2.56348259328e-14 ] [ 2.435308463616e-14 -6.184401756288e-14 1.538089555968e-14 ] [ -2.259069035328e-14 -7.850665441919999e-15 -8.491536090240001e-15 ] [ 1.04141480352e-14 2.64359142432e-14 2.194981970496e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.821491085572458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.573576339869981e-18 } }