{ "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" [ [ 2.596447 0.5894877 3.838334 ] [ 1.369077 2.86119 3.866131 ] [ 2.011058 5.105046 2.796353 ] [ 3.116098 2.834339 2.386368 ] [ 3.638135 2.33604 4.892399 ] [ 3.921466 4.7829 1.89112 ] [ 5.122204 3.316972 3.335617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.596447e-10 5.894877e-11 3.838334e-10 ] [ 1.369077e-10 2.86119e-10 3.866131e-10 ] [ 2.011058e-10 5.105046e-10 2.796353e-10 ] [ 3.116098e-10 2.834339e-10 2.386368e-10 ] [ 3.638135e-10 2.33604e-10 4.892399e-10 ] [ 3.921466e-10 4.7829e-10 1.89112e-10 ] [ 5.122204e-10 3.316972e-10 3.335617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4769533 -5.6252272 1.1728311 ] [ -7.282333 3.0798467 2.5994239 ] [ -5.0882605 2.6519036 2.0022008 ] [ -2.3787087 -7.2559174 -13.4041135 ] [ 4.1881258 -0.6232719 8.5383607 ] [ 6.3057815 6.7242888 -2.5308633 ] [ 4.7323483 1.0483775 1.6221604 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.641634264734087e-10 -9.012607506528247e-09 1.879082568567147e-09 ] [ -1.166758367748033e-08 4.934458378388032e-09 4.164736200128757e-09 ] [ -8.152292013640119e-09 4.248817948535355e-09 3.207879311907057e-09 ] [ -3.811111466833561e-09 -1.162526122073592e-08 -2.147575727224966e-08 ] [ 6.710117241729297e-09 -9.985916665815956e-10 1.367996189349752e-08 ] [ 1.010297569517315e-08 1.077349830686729e-08 -4.054890009700737e-09 ] [ 7.582057807742625e-09 1.679685920272752e-09 2.598987468067576e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.6080209 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.382863354137775e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.8550935 0.7735479 3.8174814 ] [ 1.0882943 3.4698091 3.7753259 ] [ 1.8540372 5.1278075 2.9125944 ] [ 2.8912098 1.9335291 1.6645578 ] [ 3.9941523 2.2171054 4.9710935 ] [ 3.9751209 4.9236332 2.364429 ] [ 5.116577 3.3805425 3.5008401 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8550935e-10 7.735479e-11 3.8174814e-10 ] [ 1.0882943e-10 3.4698091e-10 3.7753259e-10 ] [ 1.8540372e-10 5.127807500000001e-10 2.9125944e-10 ] [ 2.8912098e-10 1.9335291e-10 1.6645578e-10 ] [ 3.9941523e-10 2.2171054e-10 4.971093500000001e-10 ] [ 3.9751209e-10 4.9236332e-10 2.364429e-10 ] [ 5.116577000000001e-10 3.3805425e-10 3.5008401e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1935594 0.7154331 -3.4984484 ] [ 0.6841859 0.8713998 -0.799777 ] [ -0.0610896 1.1948201 0.705607 ] [ 0.3573923 -2.5790133 3.1591249 ] [ 0.1128904 0.5337259 0.1731253 ] [ -1.1911223 -0.7441138 0.4016576 ] [ -0.0958161 0.0077482 -0.1412894 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.101163454160755e-10 1.146250186566468e-09 -5.605132235555167e-09 ] [ 1.096186653261007e-09 1.396136386929796e-09 -1.281384011253561e-09 ] [ -9.787632889402368e-11 1.914312830281918e-09 1.130507038872825e-09 ] [ 5.726055875139398e-10 -4.132034813992257e-09 5.061476056967138e-09 ] [ 1.808703595927603e-10 8.551231588954387e-10 2.773773081289863e-10 ] [ -1.908388301573524e-09 -1.192201733574647e-09 6.435264162866381e-10 ] [ -1.535143153162349e-10 1.241398489328256e-11 -2.263705734468595e-10 ] ] } "relaxed-potential-energy" { "source-value" -26.243487 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.204670131966873e-18 } }