{ "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" [ [ 2.635738 2.275834 0.8013506 ] [ 2.939619 0.762978 3.027642 ] [ 4.571028 2.353947 2.00113 ] [ 3.548969 3.060298 4.401477 ] [ 3.268552 4.224197 2.762666 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.635738e-10 2.275834e-10 8.013506000000001e-11 ] [ 2.939619e-10 7.629780000000001e-11 3.027642e-10 ] [ 4.571028e-10 2.353947e-10 2.00113e-10 ] [ 3.548969e-10 3.060298e-10 4.401477e-10 ] [ 3.268552e-10 4.224197e-10 2.762666e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4559909 -0.2326747 -2.3930707 ] [ -0.6395695 -0.9984603 1.3800976 ] [ 5.1557784 -1.4102982 -2.1277417 ] [ -0.3030912 -3.3156414 6.9018838 ] [ -1.7571269 5.9570746 -3.761169 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.934931200877551e-09 -3.727859645916537e-10 -3.834121927461491e-09 ] [ -1.024703300276746e-09 -1.599709749456954e-09 2.21116010914219e-09 ] [ 8.26046761450563e-09 -2.259546804396323e-09 -3.409018006841248e-09 ] [ -4.856056346102169e-10 -5.312243134036582e-09 1.105803686383826e-08 ] [ -2.81522763895878e-09 9.544285652481514e-09 -6.026057038677715e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.5450732 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.208853988326464e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9950954 2.440781 1.3472179 ] [ 3.2730803 0.9150819 2.8550804 ] [ 5.1722016 2.3153495 2.0382311 ] [ 3.0110465 2.8502223 4.4111103 ] [ 3.5124821 4.1558194 2.3426259 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9950954e-10 2.440781e-10 1.3472179e-10 ] [ 3.2730803e-10 9.150819e-11 2.8550804e-10 ] [ 5.1722016e-10 2.3153495e-10 2.0382311e-10 ] [ 3.0110465e-10 2.8502223e-10 4.4111103e-10 ] [ 3.5124821e-10 4.1558194e-10 2.3426259e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.7e-06 2.9e-06 4.4e-06 ] [ 8e-07 1.41e-05 2.7e-06 ] [ -6.6e-06 1.5e-06 1.9e-06 ] [ 1e-06 -7.8e-06 -5.8e-06 ] [ -8e-07 -1.06e-05 -3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.13240673856e-15 4.646312200320001e-15 7.04957713152e-15 ] [ 1.28174129664e-15 2.259069035328e-14 4.32587687616e-15 ] [ -1.057436569728e-14 2.4032649312e-15 3.04413557952e-15 ] [ 1.6021766208e-15 -1.249697764224e-14 -9.292624400640001e-15 ] [ -1.28174129664e-15 -1.698307218048e-14 -5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.731874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719435762017138e-18 } }