{ "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" [ [ 0.0900209 0.6645307 1.771827 ] [ 2.257627 0.9336486 1.950206 ] [ 2.208369 3.070111 3.037465 ] [ 1.738494 0.324563 4.412062 ] [ 4.235476 0.6031948 3.631674 ] [ 3.30736 2.214082 5.333714 ] [ 4.556657 2.857436 3.382282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.002090000000001e-12 6.645307e-11 1.771827e-10 ] [ 2.257627e-10 9.336486e-11 1.950206e-10 ] [ 2.208369e-10 3.070111e-10 3.037465e-10 ] [ 1.738494e-10 3.24563e-11 4.412062e-10 ] [ 4.235476000000001e-10 6.031948e-11 3.631674e-10 ] [ 3.30736e-10 2.214082e-10 5.333714e-10 ] [ 4.556657000000001e-10 2.857436e-10 3.382282e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3923271 -0.5161971 -0.6878419 ] [ 1.5743537 -0.1953128 0.6318345 ] [ -0.4938551 0.8111662 0.0486594 ] [ 0.66198 -0.0373286 0.1613149 ] [ -0.1503261 -3.0691535 -0.5999733 ] [ -1.6535508 0.0819835 1.6470964 ] [ 2.4537254 2.9248424 -1.2010901 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.832930548926264e-09 -8.270389253447597e-10 -1.102044210986652e-09 ] [ 2.522392691009977e-09 -3.129256019029862e-10 1.012310464114858e-09 ] [ -7.91243095282846e-10 1.299631521223177e-09 7.796095306215551e-11 ] [ 1.060608879437184e-09 -5.980701020719489e-11 2.5845496136669e-10 ] [ -2.408489629160429e-10 -4.917325983346493e-09 -9.612631943642248e-10 ] [ -2.649280433065137e-09 1.313520469913568e-10 2.638939344283845e-09 ] [ 3.931301469743129e-09 4.686114112804562e-09 -1.924358477694334e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.585989 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.336933056704597e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1503264 0.3747076 1.0757983 ] [ 1.7386714 1.1527512 2.5407079 ] [ 2.3492835 3.4328293 3.1269099 ] [ 2.3657441 0.2753586 4.8339666 ] [ 4.087784 0.2972233 2.9551993 ] [ 2.9939081 2.5564588 5.4285559 ] [ 4.7082864 2.5782373 3.5580922 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.503264e-11 3.747076e-11 1.0757983e-10 ] [ 1.7386714e-10 1.1527512e-10 2.5407079e-10 ] [ 2.3492835e-10 3.4328293e-10 3.1269099e-10 ] [ 2.3657441e-10 2.753586e-11 4.8339666e-10 ] [ 4.087784e-10 2.972233e-11 2.9551993e-10 ] [ 2.9939081e-10 2.5564588e-10 5.4285559e-10 ] [ 4.708286400000001e-10 2.5782373e-10 3.5580922e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.6e-06 -1.18e-05 6e-07 ] [ -2.88e-05 4.1e-06 -4.2e-06 ] [ -7e-07 3.22e-05 -1.72e-05 ] [ 4.34e-05 2.59e-05 -2.1e-06 ] [ -3e-07 0.0 -2.6e-06 ] [ -1.75e-05 -2.33e-05 3e-07 ] [ 5.5e-06 -2.71e-05 2.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.56348259328e-15 -1.890568412544e-14 9.6130597248e-16 ] [ -4.614268667904e-14 6.568924145279999e-15 -6.72914180736e-15 ] [ -1.12152363456e-15 5.159008718975999e-14 -2.755743787776e-14 ] [ 6.953446534272e-14 4.149637447872e-14 -3.36457090368e-15 ] [ -4.8065298624e-16 0.0 -4.16565921408e-15 ] [ -2.8038090864e-14 -3.733071526464e-14 4.8065298624e-16 ] [ 8.8119714144e-15 -4.341898642368e-14 4.037485084416e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.977264 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.72005754659495e-18 } }