{ "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" [ [ -3.2389395 -5.5665765 2.8101022 ] [ -3.4689643 3.27859 -3.8378478 ] [ -0.5008647 -9.5997375 0.8695351 ] [ 4.1314253 1.0169711 0.594449 ] [ 3.0773432 10.8707529 -0.4362385 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.189353185839643e-09 -8.9186387996735e-09 4.502280083991995e-09 ] [ -5.557893545640166e-09 5.252880290466059e-09 -6.148910070008305e-09 ] [ -8.024737191354198e-10 -1.538047511503357e-08 1.393148819662853e-09 ] [ 6.61927308077644e-09 1.629367333873277e-09 9.524122979046658e-10 ] [ 4.930447369838788e-09 1.741686629036774e-08 -6.989311315512089e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.812334232689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.312386096613711e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.0229788 0.5904715 1.856997 ] [ 0.3288717 2.2478774 0.2500837 ] [ 2.0971667 0.2392191 2.8005647 ] [ 2.5684364 2.7906969 0.3255339 ] [ 2.2119124 2.5217983 2.5779985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.29788e-12 5.904715e-11 1.856997e-10 ] [ 3.288717e-11 2.2478774e-10 2.500837e-11 ] [ 2.0971667e-10 2.392191e-11 2.8005647e-10 ] [ 2.5684364e-10 2.7906969e-10 3.255339e-11 ] [ 2.2119124e-10 2.5217983e-10 2.5779985e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.8e-06 1.01e-05 2.78e-05 ] [ 2.77e-05 -6.7e-06 1.6e-05 ] [ 5.6e-06 6.2e-06 -2.31e-05 ] [ 1.04e-05 5e-06 1.37e-05 ] [ -3.9e-05 -1.46e-05 -3.43e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.690447843199998e-15 1.61819840034e-14 4.454051042519999e-14 ] [ 4.438029276179999e-14 -1.07345834478e-14 2.5634826144e-14 ] [ 8.972189150399999e-15 9.9334951308e-15 -3.70102802454e-14 ] [ 1.66626369936e-14 8.010883169999999e-15 2.19498198858e-14 ] [ -6.248488872599999e-14 -2.33917788564e-14 -5.49546585462e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.601878432689674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.858825853536394e-18 } }