{ "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" [ [ 0.1126891 1.464287 0.6414025 ] [ 1.365449 0.1265984 2.502806 ] [ 0.3364486 2.37729 2.80341 ] [ 2.851665 1.424041 0.0715282 ] [ 2.597469 0.5436052 1.609588 ] [ 2.328633 2.330176 2.375244 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.126891e-11 1.464287e-10 6.414025e-11 ] [ 1.365449e-10 1.265984e-11 2.502806e-10 ] [ 3.364486e-11 2.37729e-10 2.80341e-10 ] [ 2.851665e-10 1.424041e-10 7.15282e-12 ] [ 2.597469e-10 5.436052e-11 1.609588e-10 ] [ 2.328633e-10 2.330176e-10 2.375244e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.8185606 -0.7412312 -4.0703514 ] [ -36.6109254 -12.3003089 24.5395923 ] [ -7.3482417 0.3718964 2.198746 ] [ 0.3555114 10.3302652 -17.9789586 ] [ 37.974641 -9.9816504 -10.0053925 ] [ 9.4475754 12.321029 5.3163641 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.11800856883302e-09 -1.187583309031781e-09 -6.521421905249187e-09 ] [ -5.86571692249971e-08 -1.970726751056224e-08 3.931676139094632e-08 ] [ -1.177318115272444e-08 5.958437223487175e-10 3.522779465300963e-09 ] [ 5.695920582006275e-10 1.655090952646333e-08 -2.880546737257335e-08 ] [ 6.084208249473838e-08 -1.599236703963675e-08 -1.603040607749884e-08 ] [ 1.51366845538332e-08 1.974046477063638e-08 8.517754338856439e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.3705332 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.798012903161249e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1310494 1.3972727 0.5747159 ] [ 1.0544773 0.2301531 2.5407657 ] [ 0.1273943 2.4982281 2.7131512 ] [ 2.425908 1.6824702 0.0638383 ] [ 3.3191468 0.1309377 1.6700451 ] [ 2.5343779 2.3269357 2.4414625 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.310494e-11 1.3972727e-10 5.747159e-11 ] [ 1.0544773e-10 2.301531e-11 2.5407657e-10 ] [ 1.273943e-11 2.4982281e-10 2.7131512e-10 ] [ 2.425908e-10 1.6824702e-10 6.383830000000001e-12 ] [ 3.3191468e-10 1.309377e-11 1.6700451e-10 ] [ 2.5343779e-10 2.3269357e-10 2.4414625e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.11e-05 -5.2e-06 5.1e-06 ] [ -1.73e-05 1.07e-05 2e-07 ] [ -2.9e-06 -7.3e-06 -3.1e-06 ] [ -4.7e-06 -1.62e-05 -2.28e-05 ] [ 3.8e-06 5.5e-06 -1.55e-05 ] [ 1.01e-05 1.24e-05 3.61e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.77841606374e-14 -8.331318496799998e-15 8.1711008334e-15 ] [ -2.77176557682e-14 1.71432899838e-14 3.204353268e-16 ] [ -4.6463122386e-15 -1.16958894282e-14 -4.9667475654e-15 ] [ -7.530230179799999e-15 -2.59552614708e-14 -3.65296272552e-14 ] [ 6.088271209199999e-15 8.811971486999999e-15 -2.4833737827e-14 ] [ 1.61819840034e-14 1.98669902616e-14 5.783857648740001e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.237465 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.921964028639281e-18 } }