{ "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" [ [ 0.0082472 -0.0675273 -0.0333567 ] [ -15.7961687 5.6026822 -12.9489355 ] [ -7.5038763 -3.8709331 7.891653 ] [ -2.1828198 -8.4811621 0.311064 ] [ 19.3098218 0.3182631 -1.7012054 ] [ 6.1647958 6.4986772 6.4807806 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.321347102706176e-11 -1.081906613257478e-10 -5.344332488703936e-11 ] [ -2.530825218935273e-08 8.97648643461231e-09 -2.074648172234716e-08 ] [ -1.202253517323521e-08 -6.201918513500868e-09 1.264382193606618e-08 ] [ -3.497262850979332e-09 -1.358831963383503e-08 4.983794683725313e-10 ] [ 3.093774503977418e-08 5.099136980833326e-10 -2.725631519058712e-09 ] [ 9.877091702766033e-09 1.041202867596601e-08 1.03833551618542e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.5043645 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.410257631061482e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5036211 0.3506559 -1.2452678 ] [ 0.1668119 2.7355846 0.8340173 ] [ -1.6784475 2.5427936 2.0176896 ] [ 3.1709702 0.2258671 4.1476564 ] [ 2.0738212 1.6895257 0.4499622 ] [ 3.2030158 1.4651559 2.3283481 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5036211e-10 3.506559e-11 -1.2452678e-10 ] [ 1.668119e-11 2.7355846e-10 8.340173e-11 ] [ -1.6784475e-10 2.5427936e-10 2.0176896e-10 ] [ 3.1709702e-10 2.258671e-11 4.1476564e-10 ] [ 2.0738212e-10 1.6895257e-10 4.499622e-11 ] [ 3.2030158e-10 1.4651559e-10 2.3283481e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0580254 -0.0202699 -0.2932431 ] [ 0.1279154 -0.2040143 -0.0931989 ] [ -0.057043 0.1269655 -0.0529892 ] [ 0.1367116 0.1443805 -0.0304701 ] [ -0.5065933 0.2266437 -0.0635906 ] [ 0.2409839 -0.2737054 0.5334919 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.296693929256832e-11 -3.247595988595392e-11 -4.698272390309165e-10 ] [ 2.049430633202803e-10 -3.268669417688775e-10 -1.493210986642771e-10 ] [ -9.13929609802944e-11 2.034211557481824e-10 -8.489805739489536e-11 ] [ 2.190361293121613e-10 2.313230615994144e-10 -4.881848185343808e-11 ] [ -8.116519415139207e-10 3.63123237391609e-10 -1.018833726226445e-10 ] [ 3.860987705692051e-10 -4.385243928667124e-10 8.547482495661716e-10 ] ] } "relaxed-potential-energy" { "source-value" -12.819789 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.053956621938901e-18 } }