{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2132315 -6.8786431 7.453927 ] [ -0.3552078 7.0426289 -7.5685409 ] [ -3.2524951 -1.3568095 0.5369817 ] [ -7.2291502 3.4059137 -2.0900983 ] [ 0.909229 -8.3392189 5.8325153 ] [ 3.5433332 -6.0120637 -9.9513311 ] [ 6.5975224 12.1381926 5.7865462 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.416345241181152e-10 -1.102080115764724e-08 1.194250757254988e-08 ] [ -5.691056326858023e-10 1.128353537255042e-08 -1.212613928354859e-08 ] [ -5.211071608486559e-09 -2.173848459779338e-09 8.603395255374393e-10 ] [ -1.158237543869165e-08 5.456875302602425e-09 -3.348706631433825e-09 ] [ 1.456745446753363e-09 -1.336090155731349e-08 9.344719654118298e-09 ] [ 5.677045612744451e-09 -9.632387902900344e-09 -1.594379003425995e-08 ] [ 1.057039614448431e-08 1.944752840248757e-08 9.271069036819083e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.4046365 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.186353548582234e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.4785257 0.5758053 0.2810972 ] [ 0.6003331 1.6591198 1.8643067 ] [ 2.0884226 2.9003948 2.9130771 ] [ 2.1919431 5.0810384 3.2879187 ] [ 4.0524947 2.4069058 3.8104776 ] [ 5.2713443 4.0778715 4.5852122 ] [ 4.024576 5.8693774 4.2355039 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.785257e-11 5.758053e-11 2.810972e-11 ] [ 6.003331e-11 1.6591198e-10 1.8643067e-10 ] [ 2.0884226e-10 2.9003948e-10 2.9130771e-10 ] [ 2.1919431e-10 5.0810384e-10 3.2879187e-10 ] [ 4.0524947e-10 2.4069058e-10 3.8104776e-10 ] [ 5.2713443e-10 4.0778715e-10 4.5852122e-10 ] [ 4.024576e-10 5.8693774e-10 4.2355039e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0258941 0.0321916 0.0657748 ] [ -0.051593 -0.0526506 -0.078989 ] [ 0.0045145 0.0025406 -0.0025382 ] [ 0.0217792 0.0304386 0.0050078 ] [ 0.0352179 0.0116588 0.0084346 ] [ 0.0059343 -0.0464786 0.008166 ] [ -0.041747 0.0222997 -0.005856 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.148692163665728e-11 5.157662890614528e-11 1.053828467977958e-10 ] [ -8.266109839693441e-11 -8.435556039109248e-11 -1.265543291003712e-10 ] [ 7.233026354601601e-12 4.07048992280448e-12 -4.06664469891456e-12 ] [ 3.489412505972736e-11 4.876801328988289e-11 8.02338008164224e-12 ] [ 5.642529601367232e-11 1.867945678658304e-11 1.351371892579968e-11 ] [ 9.50779672081344e-12 -7.446692628751489e-11 1.30833742854528e-11 ] [ -6.68860673885376e-11 3.572805799085376e-11 -9.382346291404802e-12 ] ] } "relaxed-potential-energy" { "source-value" -16.514556 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.645923552609237e-18 } }