{ "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" [ [ -4.0952063 -0.3815223 0.0570992 ] [ 1.1604461 0.0753966 -0.1412317 ] [ 0.0431296 1.5129328 -1.1758084 ] [ 5.2567076 -5.25834 -5.6267284 ] [ -3.1316594 -6.5692577 7.5199041 ] [ -0.5060108 7.3539788 -5.1696383 ] [ 1.2725931 3.2668118 4.5364035 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.561243845269594e-09 -6.112661144099381e-10 9.14830040600928e-11 ] [ 1.859239626436427e-09 1.207986708030444e-10 -2.262781297200978e-10 ] [ 6.910123735376639e-11 2.423985580972195e-09 -1.883852744540926e-09 ] [ 8.422174088490217e-09 -8.424789481627558e-09 -9.015012768344206e-09 ] [ -5.017471516326459e-09 -1.052511118966458e-08 1.20482146389408e-08 ] [ -8.10718680311647e-10 1.178237300029136e-08 -8.28267369049148e-09 ] [ 2.038918929409625e-09 5.23400953363548e-09 7.268119690095818e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.302291 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.611914972086849e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4859547 3.0430527 1.8658213 ] [ 0.268724 2.3559142 1.5639657 ] [ 2.649992 4.6013344 3.8459114 ] [ 4.9441786 2.4857743 2.154641 ] [ 3.3645414 2.2106006 4.0817541 ] [ 4.2255317 4.8890192 1.9174774 ] [ 5.0775989 4.0399576 4.1167029 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4859547e-10 3.0430527e-10 1.8658213e-10 ] [ 2.68724e-11 2.3559142e-10 1.5639657e-10 ] [ 2.649992e-10 4.6013344e-10 3.8459114e-10 ] [ 4.9441786e-10 2.4857743e-10 2.154641e-10 ] [ 3.3645414e-10 2.2106006e-10 4.081754100000001e-10 ] [ 4.225531700000001e-10 4.8890192e-10 1.9174774e-10 ] [ 5.0775989e-10 4.0399576e-10 4.1167029e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0002015 1.96e-05 -1.82e-05 ] [ 7.45e-05 -8.31e-05 -2.99e-05 ] [ 7.54e-05 2.46e-05 1.35e-05 ] [ -4.33e-05 3.18e-05 1.76e-05 ] [ -3.2e-05 -0.0001023 9.41e-05 ] [ 0.0001188 0.0001361 -8.62e-05 ] [ 8.1e-06 -2.66e-05 9.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.228385917509999e-13 3.140266202639999e-14 -2.915961473879999e-14 ] [ 1.19362159233e-13 -1.331408782854e-13 -4.790508135659999e-14 ] [ 1.208041182036e-13 3.94135451964e-14 2.162938455899999e-14 ] [ -6.93742482522e-14 5.09492169612e-14 2.81983087584e-14 ] [ -5.126965228799999e-14 -1.639026696582e-13 1.507648212594e-13 ] [ 1.903385841192e-13 2.180562398874e-13 -1.381076258508e-13 ] [ 1.29776307354e-14 -4.26178984644e-14 1.45798073694e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.455452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.277324723230857e-18 } }