{ "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" [ [ 1.497272 0.041495 0.0459008 ] [ 0.5144624 2.623314 0.1336692 ] [ 0.1881884 1.665255 2.217108 ] [ 2.303156 0.3070008 2.474488 ] [ 2.009269 2.269424 0.9602388 ] [ 2.927445 2.103094 2.701001 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.497272e-10 4.1495e-12 4.59008e-12 ] [ 5.144624e-11 2.623314e-10 1.336692e-11 ] [ 1.881884e-11 1.665255e-10 2.217108e-10 ] [ 2.303156e-10 3.070008e-11 2.474488e-10 ] [ 2.009269e-10 2.269424e-10 9.602388e-11 ] [ 2.927445e-10 2.103094e-10 2.701001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1052683 -1.3335474 -0.7992013 ] [ -22.7798541 6.571042 -14.9695931 ] [ -9.6657689 -2.1939328 4.0086796 ] [ -3.9803109 -15.6517528 -0.6234178 ] [ 20.8298008 -1.0300515 -0.9260226 ] [ 15.4908649 13.6382425 13.3095552 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.686584091713606e-10 -2.136578467008626e-09 -1.280461638172967e-09 ] [ -3.649734966425502e-08 1.052796986669487e-08 -2.3983932087709e-08 ] [ -1.548626895363573e-08 -3.515067839766282e-09 6.422612735397895e-09 ] [ -6.377161067495407e-09 -2.507687241070094e-08 -9.988254241505702e-10 ] [ 3.337301985768114e-08 -1.650324431519971e-09 -1.48365176005243e-09 ] [ 2.481910157875133e-08 2.185087328230094e-08 2.132425817468707e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.3086181 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.096637325375717e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3583855 -0.044793 0.3047486 ] [ 0.1862343 2.9294531 0.5925847 ] [ -0.404895 1.4128658 2.2762431 ] [ 1.6291404 0.2621128 2.5885307 ] [ 2.4506482 2.369746 0.2487651 ] [ 3.2202794 2.0801981 2.5215336 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3583855e-10 -4.4793e-12 3.047486e-11 ] [ 1.862343e-11 2.9294531e-10 5.925846999999999e-11 ] [ -4.04895e-11 1.4128658e-10 2.2762431e-10 ] [ 1.6291404e-10 2.621128e-11 2.5885307e-10 ] [ 2.4506482e-10 2.369746e-10 2.487651e-11 ] [ 3.2202794e-10 2.0801981e-10 2.5215336e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.05e-05 -1.49e-05 7e-07 ] [ 2.09e-05 1.47e-05 1.51e-05 ] [ 4.7e-06 -1.39e-05 3.5e-06 ] [ -1.03e-05 1.47e-05 -1.85e-05 ] [ -1.72e-05 -1.43e-05 -4e-06 ] [ -8.7e-06 1.36e-05 3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.68228545184e-14 -2.387243164992e-14 1.12152363456e-15 ] [ 3.348549137472e-14 2.355199632576e-14 2.419286697408e-14 ] [ 7.53023011776e-15 -2.227025502912e-14 5.6076181728e-15 ] [ -1.650241919424e-14 2.355199632576e-14 -2.96402674848e-14 ] [ -2.755743787776e-14 -2.291112567744e-14 -6.4087064832e-15 ] [ -1.393893660096e-14 2.178960204288e-14 5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.824129 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.375087290752328e-18 } }