{ "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" [ [ 2.717363 2.851349 1.457488 ] [ 0.2108152 2.748454 1.624055 ] [ 2.409053 4.258926 3.949315 ] [ 4.77033 2.580775 2.438947 ] [ 3.623649 2.286945 4.240246 ] [ 4.139768 4.74377 1.918983 ] [ 5.145543 4.155434 3.91724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.717363e-10 2.851349e-10 1.457488e-10 ] [ 2.108152e-11 2.748454e-10 1.624055e-10 ] [ 2.409053e-10 4.258926e-10 3.949315e-10 ] [ 4.770330000000001e-10 2.580775e-10 2.438947e-10 ] [ 3.623649e-10 2.286945e-10 4.240246e-10 ] [ 4.139768e-10 4.743769999999999e-10 1.918983e-10 ] [ 5.145543e-10 4.155434e-10 3.91724e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2725766 0.9204212 1.5954773 ] [ 0.2904258 0.1110755 0.7594053 ] [ 3.7146128 -0.9084394 -4.0197722 ] [ 2.4346922 -2.8685809 -2.543016 ] [ -1.985964 -0.3654649 0.73112 ] [ -2.1985627 1.1101701 0.4812127 ] [ -0.9826275 2.0008183 2.9955728 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.038892476697153e-09 1.474677327928681e-09 2.556236429077108e-09 ] [ 4.653134268371367e-10 1.779625692436704e-10 1.21670141737161e-09 ] [ 5.951465783484426e-09 -1.455480368093579e-09 -6.440385039781782e-09 ] [ 3.900806921684118e-09 -4.595973252853422e-09 -4.074360781520333e-09 ] [ -3.181865090550452e-09 -5.8553931850301e-10 1.171383370999296e-09 ] [ -3.522485757302924e-09 1.778688579331198e-09 7.709877375720442e-10 ] [ -1.574342807455152e-09 3.205664302728801e-09 4.799436706064395e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.48521 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.602527777577837e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8584858 2.9187452 1.3774123 ] [ 0.9168948 2.6297742 2.7660721 ] [ 2.3360727 4.5156611 3.2254396 ] [ 5.017219 2.5246353 2.3819369 ] [ 3.0625644 2.1857342 3.7563225 ] [ 4.3138482 4.7803902 1.8679552 ] [ 4.5114363 4.0707129 4.1711354 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8584858e-10 2.9187452e-10 1.3774123e-10 ] [ 9.168948e-11 2.6297742e-10 2.7660721e-10 ] [ 2.3360727e-10 4.5156611e-10 3.2254396e-10 ] [ 5.017219e-10 2.5246353e-10 2.3819369e-10 ] [ 3.0625644e-10 2.1857342e-10 3.7563225e-10 ] [ 4.3138482e-10 4.7803902e-10 1.8679552e-10 ] [ 4.5114363e-10 4.0707129e-10 4.1711354e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.8e-06 -9.2e-06 -9.1e-06 ] [ 2.26e-05 1.51e-05 -5e-06 ] [ -5.1e-06 -4.9e-06 2.14e-05 ] [ -2.7e-05 9.2e-06 -8e-07 ] [ 1.46e-05 -1.57e-05 1.2e-05 ] [ 2.36e-05 -3e-06 3e-07 ] [ -2.59e-05 8.5e-06 -1.87e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.48609453824e-15 -1.474002491136e-14 -1.457980724928e-14 ] [ 3.620919163008e-14 2.419286697408e-14 -8.010883104e-15 ] [ -8.17110076608e-15 -7.850665441919999e-15 3.428657968511999e-14 ] [ -4.32587687616e-14 1.474002491136e-14 -1.28174129664e-15 ] [ 2.339177866368e-14 -2.515417294656e-14 1.92261194496e-14 ] [ 3.781136825088e-14 -4.8065298624e-15 4.8065298624e-16 ] [ -4.149637447872e-14 1.36185012768e-14 -2.996070280896e-14 ] ] } "relaxed-potential-energy" { "source-value" -29.696935 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.757973496641725e-18 } }