{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3399421 -1.4630882 -0.0109825 ] [ -2.2190354 -0.1247431 0.3181949 ] [ 1.3718096 1.3548454 0.6916813 ] [ -1.0200479 1.4843016 1.300204 ] [ 1.6157264 -1.2335433 -2.5005063 ] [ -0.3846676 1.4814585 0.1441409 ] [ -0.7037273 -1.4992308 0.0572677 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.146823905845656e-09 -2.344125708208354e-09 -1.7595904737936e-11 ] [ -3.555286638607577e-09 -1.998604784261165e-10 5.09804429637794e-10 ] [ 2.197881269309e-09 2.170701624678425e-09 1.108195607904551e-09 ] [ -1.634296897476136e-09 2.378113321736033e-09 2.083156451070643e-09 ] [ 2.588679063689349e-09 -1.976354236004481e-09 -4.006252734023111e-09 ] [ -6.16305435499246e-10 2.373558173385437e-09 2.309391800810707e-10 ] [ -1.127495427478708e-09 -2.402032536943281e-09 9.175297006698816e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -29.420578 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.713696224202282e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9892156 2.56311 2.874565 ] [ 2.6031302 0.9089358 5.5779874 ] [ 2.1552709 0.2664583 3.3947172 ] [ 3.6337962 1.1891831 1.828571 ] [ 4.387096 0.8071487 4.0291884 ] [ 3.482729 2.8805959 4.6737456 ] [ 4.1758691 3.3479706 2.4868185 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9892156e-10 2.56311e-10 2.874565e-10 ] [ 2.6031302e-10 9.089358e-11 5.577987399999999e-10 ] [ 2.1552709e-10 2.664583e-11 3.3947172e-10 ] [ 3.6337962e-10 1.1891831e-10 1.828571e-10 ] [ 4.387096e-10 8.071487e-11 4.0291884e-10 ] [ 3.482729e-10 2.8805959e-10 4.673745600000001e-10 ] [ 4.1758691e-10 3.3479706e-10 2.4868185e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.05e-05 3.47e-05 -9.83e-05 ] [ 6.04e-05 -4.57e-05 1.67e-05 ] [ -5.07e-05 1.36e-05 4.44e-05 ] [ 1.56e-05 3.83e-05 -3.17e-05 ] [ 6.16e-05 -0.0001175 3.82e-05 ] [ -7.75e-05 6.34e-05 0.0001156 ] [ 2.1e-05 1.32e-05 -8.49e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.88663869344e-14 5.559552874176001e-14 -1.5749396182464e-13 ] [ 9.677146789632e-14 -7.321947157056e-14 2.675634956736e-14 ] [ -8.123035467456e-14 2.178960204288e-14 7.113664196352e-14 ] [ 2.499395528448e-14 6.136336457664001e-14 -5.078899887936e-14 ] [ 9.869407984128002e-14 -1.88255752944e-13 6.120314691456e-14 ] [ -1.24168688112e-13 1.0157799775872e-13 1.8521161736448e-13 ] [ 3.36457090368e-14 2.114873139456e-14 -1.3602479510592e-13 ] ] } "relaxed-potential-energy" { "source-value" -30.311464 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.856431896302086e-18 } }