{ "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" [ [ 0.6678483 0.3705928 0.1642866 ] [ 0.4651457 2.25942 0.9775642 ] [ 2.325854 0.8972553 0.6909246 ] [ 2.51877 2.867173 0.7641457 ] [ 2.596702 2.283556 2.674442 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.678483e-11 3.705928e-11 1.642866e-11 ] [ 4.651457e-11 2.25942e-10 9.775642000000001e-11 ] [ 2.325854e-10 8.972553e-11 6.909246e-11 ] [ 2.51877e-10 2.867173e-10 7.641457000000001e-11 ] [ 2.596702e-10 2.283556e-10 2.674442e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -256.2244191 -110.0203914 -97.2649052 ] [ -30.6600594 40.5156893 15.6480579 ] [ 271.456714 -2.8367211 73.038094 ] [ 8.1909695 93.3176893 -85.0787196 ] [ 7.236795 -20.9762661 93.657473 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.10516773960081e-07 -1.762720989123454e-07 -1.558355571357684e-07 ] [ -4.912283036301928e-08 6.491329017205672e-08 2.507095252830474e-08 ] [ 4.34921600729992e-07 -4.544928226150059e-09 1.170199266345928e-07 ] [ 1.312337983458587e-08 1.495114201035383e-07 -1.363111354707187e-07 ] [ 1.159462375852233e-08 -3.36076831370996e-08 1.500558136038072e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 71.320839 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.142685808216409e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.4385729 0.2195141 0.1498393 ] [ 0.2659047 2.5301367 1.224859 ] [ 2.9000209 0.6276964 0.6967496 ] [ 2.6607493 3.234511 0.3725532 ] [ 2.3090721 2.0661389 2.8273619 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.385729e-11 2.195141e-11 1.498393e-11 ] [ 2.659047e-11 2.5301367e-10 1.224859e-10 ] [ 2.9000209e-10 6.276964e-11 6.967496e-11 ] [ 2.6607493e-10 3.234511e-10 3.725532e-11 ] [ 2.3090721e-10 2.0661389e-10 2.8273619e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2e-06 2.3e-05 1.26e-05 ] [ -1.15e-05 -2.8e-05 -1.96e-05 ] [ -6.2e-06 -2.88e-05 -7.5e-06 ] [ 3.3e-06 1.87e-05 1.73e-05 ] [ 1.24e-05 1.51e-05 -2.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.2043532416e-15 3.68500622784e-14 2.018742542208e-14 ] [ -1.84250311392e-14 -4.48609453824e-14 -3.140266176767999e-14 ] [ -9.93349504896e-15 -4.614268667904e-14 -1.2016324656e-14 ] [ 5.28718284864e-15 2.996070280896e-14 2.771765553984e-14 ] [ 1.986699009792e-14 2.419286697408e-14 -4.32587687616e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.556674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.652671600100722e-18 } }