{ "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" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.5027978 -5.9686987 -7.7970635 ] [ -0.4753885 -17.8268487 10.751615 ] [ 0.047861 7.2176642 -3.619581 ] [ -12.0839724 9.457217 -2.4706659 ] [ 2.8625722 -2.6493267 0.0785564 ] [ 1.3713731 3.8205757 -6.4672433 ] [ 15.7803524 5.9494172 9.5243823 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.20208073247866e-08 -9.562909592526175e-09 -1.249227295351426e-08 ] [ -7.616563467723089e-10 -2.856176044499327e-08 1.722598633076391e-08 ] [ 7.668177587987399e-11 1.15639729332983e-08 -5.799208103070353e-09 ] [ -1.93606582251809e-08 1.515213210006758e-08 -3.95844317540058e-09 ] [ 4.586346291977974e-09 -4.244689334572328e-09 1.258612285311576e-10 ] [ 2.197181937316145e-09 6.121237114968193e-09 -1.036166610165305e-08 ] [ 2.528291189156582e-08 9.532017223757705e-09 1.525974277434318e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -16.330713 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.616468678516004e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6924246 1.9527041 3.0834091 ] [ 2.2915976 1.3713698 5.5434014 ] [ 2.9408243 4.4901165 2.9153741 ] [ 1.3164271 3.5032534 4.5598231 ] [ 4.5613254 1.2835981 1.6714232 ] [ 3.8946599 3.4229451 1.032011 ] [ 3.8478971 3.2784701 4.9034777 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6924246e-10 1.9527041e-10 3.0834091e-10 ] [ 2.2915976e-10 1.3713698e-10 5.5434014e-10 ] [ 2.9408243e-10 4.4901165e-10 2.915374100000001e-10 ] [ 1.3164271e-10 3.5032534e-10 4.5598231e-10 ] [ 4.561325400000001e-10 1.2835981e-10 1.6714232e-10 ] [ 3.8946599e-10 3.4229451e-10 1.032011e-10 ] [ 3.8478971e-10 3.2784701e-10 4.9034777e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.000162 0.0002449 -0.0001911 ] [ -2.12e-05 -3.12e-05 0.0001912 ] [ 0.0001104 -0.0001656 0.0001781 ] [ 3.03e-05 -1.44e-05 -0.0001578 ] [ 5.6e-06 -2.11e-05 -0.0001429 ] [ -0.0001606 -0.0001128 0.000133 ] [ -0.0001263 0.0001002 -1.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.59552614708e-13 3.923730576666e-13 -3.061759547574e-13 ] [ -3.39661446408e-14 -4.998791098079999e-14 3.063361724208e-13 ] [ 1.768803003936e-13 -2.653204505903999e-13 2.853476585154e-13 ] [ 4.854595201019999e-14 -2.30713435296e-14 -2.528234728452e-13 ] [ 8.972189150399999e-15 -3.38059269774e-14 -2.289510409986e-13 ] [ -2.573095674204e-13 -1.807255243152e-13 2.13089492322e-13 ] [ -2.023549088742e-13 1.605380987268e-13 -1.66626369936e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.973196 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.001147110750227e-18 } }