{ "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" [ [ 2.430797 0.9143471 3.003228 ] [ 2.900858 2.600657 5.132587 ] [ 1.698571 3.470708 2.452381 ] [ 4.30988 2.177249 1.737833 ] [ 5.127339 2.024866 3.874492 ] [ 3.797222 3.704908 3.463102 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.430797e-10 9.143471e-11 3.003228e-10 ] [ 2.900858e-10 2.600657e-10 5.132587e-10 ] [ 1.698571e-10 3.470708e-10 2.452381e-10 ] [ 4.30988e-10 2.177249e-10 1.737833e-10 ] [ 5.127339e-10 2.024866e-10 3.874492e-10 ] [ 3.797222e-10 3.704908e-10 3.463102e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5853573 -2.3464568 -0.5507035 ] [ -3.1215492 -2.2031576 5.0503048 ] [ -2.868055 0.1955528 -1.4159755 ] [ 0.8769136 -2.831376 -6.2998825 ] [ 7.8094618 -4.8459972 3.4648445 ] [ -0.1114139 12.0314348 -0.2485878 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.142199022474612e-09 -3.759438226677181e-09 -8.823242726927328e-10 ] [ -5.001273148916943e-09 -3.529847598657838e-09 8.091480278474021e-09 ] [ -4.595130668168544e-09 3.133101242919782e-10 -2.268642841725591e-09 ] [ 1.404970468381563e-09 -4.536364431894221e-09 -1.009352445528706e-08 ] [ 1.251213711699069e-08 -7.764143418302261e-09 5.551292852607465e-09 ] [ -1.785047458121491e-10 1.927648355123952e-08 -3.982815613761063e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.9495927 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.433882818962235e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2788125 1.1952132 2.9343452 ] [ 3.2344974 2.3818227 4.9948946 ] [ 1.3917027 3.4016048 2.4116688 ] [ 4.4492032 2.1523433 1.9645232 ] [ 5.3631861 1.5626403 4.1428721 ] [ 3.5472651 4.1991108 3.2153191 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2788125e-10 1.1952132e-10 2.9343452e-10 ] [ 3.2344974e-10 2.3818227e-10 4.994894600000001e-10 ] [ 1.3917027e-10 3.4016048e-10 2.4116688e-10 ] [ 4.4492032e-10 2.1523433e-10 1.9645232e-10 ] [ 5.3631861e-10 1.5626403e-10 4.1428721e-10 ] [ 3.5472651e-10 4.1991108e-10 3.2153191e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.7e-06 3.6e-06 -9e-07 ] [ 2e-07 4.5e-06 -9.9e-06 ] [ 8.4e-06 -3.8e-06 3.8e-06 ] [ -8.4e-06 -5e-07 5.7e-06 ] [ -6.5e-06 2.9e-06 -2.7e-06 ] [ -4e-07 -6.7e-06 4.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.073458335936e-14 5.76783583488e-15 -1.44195895872e-15 ] [ 3.2043532416e-16 7.2097947936e-15 -1.586154854592e-14 ] [ 1.345828361472e-14 -6.08827115904e-15 6.08827115904e-15 ] [ -1.345828361472e-14 -8.010883104e-16 9.13240673856e-15 ] [ -1.04141480352e-14 4.646312200320001e-15 -4.32587687616e-15 ] [ -6.408706483200001e-16 -1.073458335936e-14 6.568924145279999e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.001668 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.243314512180349e-18 } }