{ "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" [ [ -5.4483506 -1.110638 -2.8969788 ] [ 1.6690391 0.3063686 0.3485493 ] [ -2.927854 1.6412808 0.3976067 ] [ 6.1731465 -8.1680142 -5.5491701 ] [ -3.1829028 -4.7333796 5.8010008 ] [ -1.0816772 6.878333 -3.984949 ] [ 4.7985989 5.1860494 5.8839411 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.729219953241653e-09 -1.779438237772071e-09 -4.641471704313239e-09 ] [ 2.674095425221073e-09 4.908566082672269e-10 5.584375396562054e-10 ] [ -4.690939227915763e-09 2.629621725927921e-09 6.370361590134394e-10 ] [ 9.890470999073347e-09 -1.308660138960242e-08 -8.890750599062399e-09 ] [ -5.099572452438858e-09 -7.583710132491657e-09 9.294227859002095e-09 ] [ -1.733037921092406e-09 1.102030432267712e-08 -6.384592122880339e-09 ] [ 7.688202970176598e-09 8.308967102993867e-09 9.427112868584236e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.586121 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.176736543355992e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.2042742 3.0519913 0.8756035 ] [ 1.1229205 2.9341413 1.9832032 ] [ 1.861495 4.1112596 3.8914958 ] [ 4.5407249 1.8298954 2.4325802 ] [ 3.5568365 2.6059484 4.6422689 ] [ 3.4706876 5.0903955 2.2711667 ] [ 5.2595825 4.0020216 3.4499558 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.2042742e-10 3.0519913e-10 8.756035e-11 ] [ 1.1229205e-10 2.9341413e-10 1.9832032e-10 ] [ 1.861495e-10 4.111259600000001e-10 3.8914958e-10 ] [ 4.5407249e-10 1.8298954e-10 2.4325802e-10 ] [ 3.5568365e-10 2.6059484e-10 4.642268900000001e-10 ] [ 3.4706876e-10 5.0903955e-10 2.2711667e-10 ] [ 5.2595825e-10 4.0020216e-10 3.4499558e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.2e-06 -2e-06 -2.74e-05 ] [ -3.57e-05 -1.26e-05 -3.14e-05 ] [ -4.6e-06 -2.6e-06 9.1e-06 ] [ -1.63e-05 9.7e-06 1.46e-05 ] [ 3.14e-05 1.99e-05 1.12e-05 ] [ -1.7e-06 1.3e-06 1.98e-05 ] [ 2.08e-05 -1.38e-05 4.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.93349504896e-15 -3.2043532416e-15 -4.389963940992e-14 ] [ -5.719770536256001e-14 -2.018742542208e-14 -5.030834589312e-14 ] [ -7.370012455680001e-15 -4.16565921408e-15 1.457980724928e-14 ] [ -2.611547891904e-14 1.554111322176e-14 2.339177866368e-14 ] [ 5.030834589312e-14 3.188331475392e-14 1.794437815296e-14 ] [ -2.72370025536e-15 2.08282960704e-15 3.172309709184e-14 ] [ 3.332527371264e-14 -2.211003736704e-14 6.568924145279999e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.439394 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.11453425893198e-18 } }