{ "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" [ [ 2.586158 0.6938923 0.8841089 ] [ 2.34485 2.26041 2.433738 ] [ 3.767171 2.568287 0.2210666 ] [ 4.342877 1.484782 1.999902 ] [ 4.214846 3.620834 1.934125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586158e-10 6.938923e-11 8.841089e-11 ] [ 2.34485e-10 2.26041e-10 2.433738e-10 ] [ 3.767171e-10 2.568287e-10 2.210666e-11 ] [ 4.342877e-10 1.484782e-10 1.999902e-10 ] [ 4.214846e-10 3.620834e-10 1.934125e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.322387 -2.4699667 -2.0292771 ] [ -4.3590549 1.643296 2.9306939 ] [ -1.2652202 0.3045689 -9.9217659 ] [ 6.642504 -7.3644367 4.675613 ] [ 1.3041582 7.8865385 4.3447361 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.720874155849849e-09 -3.957322900894528e-09 -3.251260326744824e-09 ] [ -6.983975849563683e-09 2.632850432254157e-09 4.695489249301173e-09 ] [ -2.0271062246039e-09 4.879731710027731e-10 -1.589642136203067e-08 ] [ 1.064246461237048e-08 -1.17991283061015e-08 7.49115783650855e-09 ] [ 2.089491777864611e-09 1.26356276037391e-08 6.961034602965772e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.794110399234949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.476658357588389e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.4639784 0.9212279 0.8172565 ] [ 2.3562222 2.2004701 2.7905082 ] [ 4.0502038 2.4190647 -0.067147 ] [ 4.4430407 1.3891418 2.0262123 ] [ 3.9424569 3.6983008 1.9061104 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4639784e-10 9.212279e-11 8.172565000000001e-11 ] [ 2.3562222e-10 2.2004701e-10 2.7905082e-10 ] [ 4.050203800000001e-10 2.4190647e-10 -6.7147e-12 ] [ 4.4430407e-10 1.3891418e-10 2.0262123e-10 ] [ 3.9424569e-10 3.698300800000001e-10 1.9061104e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.76e-05 3e-05 1e-05 ] [ 1.42e-05 1e-06 -4.9e-06 ] [ 6e-07 -1.6e-06 2.2e-05 ] [ -1.83e-05 3.44e-05 -1.04e-05 ] [ -1.41e-05 -6.38e-05 -1.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.819830852608e-14 4.8065298624e-14 1.6021766208e-14 ] [ 2.275090801536e-14 1.6021766208e-15 -7.850665441919999e-15 ] [ 9.6130597248e-16 -2.56348259328e-15 3.52478856576e-14 ] [ -2.931983216064e-14 5.511487575552001e-14 -1.666263685632e-14 ] [ -2.259069035328e-14 -1.0221886840704e-13 -2.675634956736e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }