{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.922149 2.490454 3.411092 ] [ 2.441615 3.416271 1.506229 ] [ 2.671317 4.814549 3.971801 ] [ 3.703717 1.527403 2.621349 ] [ 3.855488 2.690161 4.660198 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.922149e-10 2.490454e-10 3.411092e-10 ] [ 2.441615e-10 3.416271e-10 1.506229e-10 ] [ 2.671317e-10 4.814549e-10 3.971801e-10 ] [ 3.703717e-10 1.527403e-10 2.621349e-10 ] [ 3.855488e-10 2.690161e-10 4.660198e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.0023603 0.8940512 3.3151693 ] [ 1.4021229 1.6070364 -0.0390957 ] [ 0.0677435 -2.8404988 -1.9093907 ] [ 2.1145991 -0.9195072 -2.0567966 ] [ 0.4178948 1.2589184 0.6901137 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.412488100678075e-09 1.432427930438185e-09 5.311486746453902e-09 ] [ 2.246448529868296e-09 2.574756148854597e-09 -6.263821651381056e-11 ] [ 1.085370519111648e-10 -4.550980768770455e-09 -3.059181139512946e-09 ] [ 3.387961240384721e-09 -1.47321293849727e-09 -3.29535142626093e-09 ] [ 6.695412785138919e-10 2.017009627974943e-09 1.105684035833785e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.067345 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.414054789652778e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6820194 2.4133569 3.6130899 ] [ 3.0682558 3.562172 1.9491974 ] [ 2.330739 4.7198251 3.9400333 ] [ 3.5069768 1.25571 2.5282335 ] [ 4.006295 2.987774 4.1401149 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6820194e-10 2.4133569e-10 3.6130899e-10 ] [ 3.0682558e-10 3.562172e-10 1.9491974e-10 ] [ 2.330739e-10 4.719825100000001e-10 3.9400333e-10 ] [ 3.5069768e-10 1.25571e-10 2.5282335e-10 ] [ 4.006295e-10 2.987774e-10 4.140114900000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.9e-06 -1.17e-05 2.1e-06 ] [ 8.9e-06 -1.5e-06 -2e-05 ] [ -9.3e-06 1.38e-05 1.01e-05 ] [ -5.3e-06 4.5e-06 3.1e-06 ] [ 1.45e-05 -5.1e-06 4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.425937192512e-14 -1.874546646336e-14 3.36457090368e-15 ] [ 1.425937192512e-14 -2.4032649312e-15 -3.2043532416e-14 ] [ -1.490024257344e-14 2.211003736704e-14 1.618198387008e-14 ] [ -8.491536090240001e-15 7.2097947936e-15 4.96674752448e-15 ] [ 2.32315610016e-14 -8.17110076608e-15 7.69044777984e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }