{ "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" [ [ 2.8328 1.144076 3.909989 ] [ 1.831555 2.949109 3.983595 ] [ 4.980623 2.123246 2.998848 ] [ 3.28235 2.585733 1.880535 ] [ 4.448764 2.855471 5.04642 ] [ 4.331941 4.016039 3.033368 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8328e-10 1.144076e-10 3.909989e-10 ] [ 1.831555e-10 2.949109e-10 3.983595000000001e-10 ] [ 4.980622999999999e-10 2.123246e-10 2.998848e-10 ] [ 3.28235e-10 2.585733e-10 1.880535e-10 ] [ 4.448764e-10 2.855471e-10 5.04642e-10 ] [ 4.331941e-10 4.016039e-10 3.033368e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.7512514 -24.5175346 8.5187303 ] [ -23.6925949 6.0473125 6.7314472 ] [ 27.6358975 -17.7304791 -6.5566216 ] [ -11.4017223 -0.5812088 -29.3380275 ] [ 10.2130353 3.6831902 25.6554919 ] [ 8.9966359 33.0987198 -5.0110203 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.882758025822327e-08 -3.928142073577508e-08 1.364851052556057e-08 ] [ -3.795972163486531e-08 9.6888627061716e-09 1.078496732798962e-08 ] [ 4.427758886932517e-08 -2.840735908960303e-08 -1.050486583895229e-08 ] [ -1.8267572905914e-08 -9.31199151163223e-10 -4.700470176088748e-08 ] [ 1.636308638506511e-08 5.901121228399675e-09 4.110462931730377e-08 ] [ 1.441419970482997e-08 5.302999504197005e-08 -8.028539571014202e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 19.713184 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.158400252632863e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6118904 0.6669006 4.3551285 ] [ 1.3110218 2.2708798 3.1123702 ] [ 4.6747418 1.429994 3.3477519 ] [ 3.2809044 3.1485975 2.0161722 ] [ 5.5651704 3.2766646 4.6320489 ] [ 4.2643042 4.8806375 3.3892833 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6118904e-10 6.669006e-11 4.355128500000001e-10 ] [ 1.3110218e-10 2.2708798e-10 3.1123702e-10 ] [ 4.674741799999999e-10 1.429994e-10 3.3477519e-10 ] [ 3.2809044e-10 3.1485975e-10 2.0161722e-10 ] [ 5.565170400000001e-10 3.2766646e-10 4.6320489e-10 ] [ 4.2643042e-10 4.8806375e-10 3.3892833e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.3e-06 7.5e-06 2.29e-05 ] [ -1.44e-05 1.52e-05 3.4e-06 ] [ 1.97e-05 -1.55e-05 -2.99e-05 ] [ -9.2e-06 -1.04e-05 -4.62e-05 ] [ 1.96e-05 -1.15e-05 4.61e-05 ] [ -2.11e-05 1.45e-05 3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.491536090240001e-15 1.2016324656e-14 3.668984461632e-14 ] [ -2.307134333952e-14 2.435308463616e-14 5.44740051072e-15 ] [ 3.156287942976e-14 -2.48337376224e-14 -4.790508096192e-14 ] [ -1.474002491136e-14 -1.666263685632e-14 -7.402055988096e-14 ] [ 3.140266176767999e-14 -1.84250311392e-14 7.386034221888001e-14 ] [ -3.380592669888e-14 2.32315610016e-14 5.76783583488e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.987622 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.241064094898774e-18 } }