{ "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" [ [ 0.1446516 0.7602583 1.64121 ] [ 0.5863284 2.091282 0.4918312 ] [ 1.988461 0.5220119 2.855455 ] [ 2.293973 2.837851 0.0455476 ] [ 2.215952 2.17866 2.777134 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.446516e-11 7.602583e-11 1.64121e-10 ] [ 5.863284e-11 2.091282e-10 4.918312e-11 ] [ 1.988461e-10 5.220119e-11 2.855455e-10 ] [ 2.293973e-10 2.837851e-10 4.55476e-12 ] [ 2.215952e-10 2.17866e-10 2.777134e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8705744 -4.8109519 3.3164657 ] [ -3.3400696 2.9574388 -3.0022602 ] [ 0.1148441 -9.1290901 1.3628089 ] [ 4.8431778 1.8405171 -0.5110122 ] [ 1.2526221 9.1420861 -1.1660021 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.599167191946988e-09 -7.707994657973339e-09 5.313563808225107e-09 ] [ -5.351381424964808e-09 4.738339302806807e-09 -4.810151101998332e-09 ] [ 1.840005320568173e-10 -1.462641472739674e-08 2.183460558198165e-09 ] [ 7.759626241537579e-09 2.948833467802616e-09 -8.187317997835739e-10 ] [ 2.006921843317399e-09 1.464723661476065e-08 -1.868141304423704e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.601014 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.538252016677349e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1019409 0.697041 2.016744 ] [ 0.4183192 2.4099777 0.3860611 ] [ 2.4668514 0.4526745 2.2188758 ] [ 2.7832296 2.1656081 0.5881896 ] [ 1.4590248 2.6647618 2.6013074 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.019409e-11 6.97041e-11 2.016744e-10 ] [ 4.183192e-11 2.4099777e-10 3.860611e-11 ] [ 2.4668514e-10 4.526745e-11 2.2188758e-10 ] [ 2.7832296e-10 2.1656081e-10 5.881896e-11 ] [ 1.4590248e-10 2.6647618e-10 2.6013074e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.42e-05 -1.94e-05 5.8e-06 ] [ -2.74e-05 1.34e-05 -3.67e-05 ] [ 2.72e-05 -3.79e-05 1.08e-05 ] [ 2.42e-05 6.1e-06 -1.93e-05 ] [ 2e-07 3.77e-05 3.95e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.877267422336e-14 -3.108222644352e-14 9.292624400640001e-15 ] [ -4.389963940992e-14 2.146916671872e-14 -5.879988198335999e-14 ] [ 4.357920408576e-14 -6.072249392832e-14 1.730350750464e-14 ] [ 3.877267422336e-14 9.77327738688e-15 -3.092200878144e-14 ] [ 3.2043532416e-16 6.040205860416e-14 6.32859765216e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }