{ "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" [ [ 0.09862 0.3102875 1.608695 ] [ 0.216089 2.435481 0.8089597 ] [ 1.587261 0.9923217 0.3598848 ] [ 2.442881 2.780277 0.9615339 ] [ 1.769015 1.574471 2.844855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.862e-12 3.102875e-11 1.608695e-10 ] [ 2.16089e-11 2.435481e-10 8.089597e-11 ] [ 1.587261e-10 9.923217e-11 3.598848e-11 ] [ 2.442881e-10 2.780277e-10 9.615339e-11 ] [ 1.769015e-10 1.574471e-10 2.844855e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.4088647 -3.5317837 4.8783551 ] [ -7.2748723 6.6399587 0.3297402 ] [ 6.9014258 -8.5241708 -7.8060146 ] [ 4.7508027 5.7627938 2.0862965 ] [ 0.0315086 -0.346798 0.5116228 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.063779946610405e-09 -5.658541273862521e-09 7.815986489180447e-09 ] [ -1.165563031836553e-08 1.063838659221756e-08 5.283020393779161e-10 ] [ 1.105730306694594e-08 -1.365722716746603e-08 -1.250661409374346e-08 ] [ 7.611625015973516e-09 9.23301349685119e-09 3.342615476356867e-09 ] [ 5.048234227413887e-11 -5.556316477401985e-10 8.197100888282343e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -2.2546643992349473 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.61237058820431e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2204427 0.4888655 1.8026901 ] [ 0.085259 2.4821641 0.5318765 ] [ 1.6072032 0.8692932 -0.0784391 ] [ 2.347575 2.729675 1.1854143 ] [ 1.853386 1.5228405 3.1423866 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.204427e-11 4.888655e-11 1.8026901e-10 ] [ 8.5259e-12 2.4821641e-10 5.318765e-11 ] [ 1.6072032e-10 8.692932e-11 -7.84391e-12 ] [ 2.347575e-10 2.729675e-10 1.1854143e-10 ] [ 1.853386e-10 1.5228405e-10 3.1423866e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.7e-06 5e-06 -1.9e-05 ] [ -2.37e-05 -2.31e-05 -1.91e-05 ] [ -8.5e-06 5.09e-05 5.1e-05 ] [ 1.68e-05 -4.06e-05 9e-07 ] [ 1.27e-05 7.8e-06 -1.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.32587687616e-15 8.010883104e-15 -3.04413557952e-14 ] [ -3.797158591296e-14 -3.701027994048e-14 -3.060157345728e-14 ] [ -1.36185012768e-14 8.155078999872e-14 8.17110076608e-14 ] [ 2.691656722944e-14 -6.504837080448e-14 1.44195895872e-15 ] [ 2.034764308416e-14 1.249697764224e-14 -2.211003736704e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.092110399234951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.158460232186793e-19 } }