{ "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" [ [ 0.4711414 1.535718 0.6051258 ] [ 0.1383881 2.176586 2.72717 ] [ 2.449817 0.7251628 0.0780297 ] [ 1.858809 0.1214998 2.575793 ] [ 2.444403 2.05802 2.37174 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.711414e-11 1.535718e-10 6.051258000000001e-11 ] [ 1.383881e-11 2.176586e-10 2.72717e-10 ] [ 2.449817e-10 7.251628e-11 7.80297e-12 ] [ 1.858809e-10 1.214998e-11 2.575793e-10 ] [ 2.444403e-10 2.05802e-10 2.37174e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.843624 1.5343207 -4.6401145 ] [ -4.3017036 3.2422567 4.7553784 ] [ 6.0306383 -2.3888727 -2.8396358 ] [ -3.7318551 -21.807733 3.7701157 ] [ 8.8465443 19.4200282 -1.0457438 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.096469437434578e-08 2.458252754349491e-09 -7.434282969735082e-09 ] [ -6.892088937531194e-09 5.194667883372159e-09 7.61895609553731e-09 ] [ 9.662147692761056e-09 -3.827395990007372e-09 -4.549598090346704e-09 ] [ -5.979090993433247e-09 -3.493983996524864e-08 6.040391232251026e-09 ] [ 1.41737264523315e-08 3.111431515731671e-08 -1.675466267706551e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.9708193 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.361953847881422e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.0047851 1.4812583 0.3069074 ] [ 0.1838541 2.654664 2.4695308 ] [ 2.394638 0.9388134 0.4078051 ] [ 2.2077032 -0.5567322 2.6275573 ] [ 2.5811482 2.098983 2.5460579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.785099999999999e-13 1.4812583e-10 3.069074e-11 ] [ 1.838541e-11 2.654664e-10 2.4695308e-10 ] [ 2.394638e-10 9.388134e-11 4.078051e-11 ] [ 2.2077032e-10 -5.567322e-11 2.6275573e-10 ] [ 2.5811482e-10 2.098983e-10 2.5460579e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.5e-06 1e-07 -1.33e-05 ] [ -6.9e-06 3.7e-06 1.06e-05 ] [ -2.3e-06 -6.1e-06 -1.29e-05 ] [ 3e-06 5e-07 6.2e-06 ] [ 7.7e-06 1.8e-06 9.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.4032649312e-15 1.6021766208e-16 -2.130894905664e-14 ] [ -1.105501868352e-14 5.928053496960001e-15 1.698307218048e-14 ] [ -3.68500622784e-15 -9.77327738688e-15 -2.066807840832e-14 ] [ 4.8065298624e-15 8.010883104e-16 9.93349504896e-15 ] [ 1.233675998016e-14 2.88391791744e-15 1.506046023552e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.065358 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.933083450918225e-18 } }