{ "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" [ [ 2.872342 2.592209 3.748836 ] [ 1.410068 4.838391 2.869154 ] [ 2.889421 3.430048 1.520903 ] [ 4.604684 2.417867 2.466033 ] [ 4.898299 2.012755 4.844446 ] [ 5.379024 4.52793 1.309626 ] [ 5.720081 4.239448 3.464417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872342e-10 2.592209e-10 3.748836e-10 ] [ 1.410068e-10 4.838391e-10 2.869154e-10 ] [ 2.889421e-10 3.430048e-10 1.520903e-10 ] [ 4.604684e-10 2.417867e-10 2.466033e-10 ] [ 4.898299e-10 2.012755e-10 4.844446e-10 ] [ 5.379024e-10 4.52793e-10 1.309626e-10 ] [ 5.720081000000001e-10 4.239448000000001e-10 3.464417e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5663163 0.9229875 1.0175872 ] [ 1.697302 -1.8739586 -0.1032175 ] [ -0.7413915 1.840679 -0.2998394 ] [ 2.7851527 -0.7828703 -0.6152857 ] [ 0.0750894 1.3420324 -0.9676218 ] [ -1.4226537 -0.5413696 -0.6212986 ] [ 0.1728174 -0.9075004 1.5896758 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.111692011313334e-09 1.478789005974075e-09 1.630354434897485e-09 ] [ 2.719377605241468e-09 -3.002412682003352e-09 -1.65372666719895e-10 ] [ -1.187840137946211e-09 2.949092884494486e-09 -4.803956806325796e-10 ] [ 4.46230657806201e-09 -1.25429650211257e-09 -9.857963717743339e-10 ] [ 1.203064821410796e-10 2.150172953350941e-09 -1.550301038509021e-09 ] [ -2.279342516413645e-09 -8.673697234779263e-10 -9.954300996569123e-10 ] [ 2.768840002286316e-10 -1.453975936225653e-09 2.546941422395257e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.670717 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.151596315142658e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.630282 2.4477989 4.0377184 ] [ 1.7795314 4.2863556 3.0177296 ] [ 3.0591175 3.9870764 1.1690703 ] [ 4.1675713 2.1127469 2.2083848 ] [ 4.9224547 2.5809211 4.4518096 ] [ 5.3512874 4.1202118 1.5831615 ] [ 5.8636748 4.5235373 3.7555409 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.630282e-10 2.4477989e-10 4.0377184e-10 ] [ 1.7795314e-10 4.286355600000001e-10 3.0177296e-10 ] [ 3.0591175e-10 3.9870764e-10 1.1690703e-10 ] [ 4.1675713e-10 2.1127469e-10 2.2083848e-10 ] [ 4.9224547e-10 2.5809211e-10 4.4518096e-10 ] [ 5.351287400000001e-10 4.1202118e-10 1.5831615e-10 ] [ 5.863674800000001e-10 4.5235373e-10 3.7555409e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.3e-06 -3.4e-06 4e-06 ] [ -4.9e-06 2.06e-05 6e-07 ] [ -1.88e-05 1.32e-05 5.8e-06 ] [ 1.22e-05 -1.5e-05 2.2e-06 ] [ 7.2e-06 -2.29e-05 8e-07 ] [ 3.07e-05 -1.48e-05 -1.81e-05 ] [ -3.17e-05 2.23e-05 4.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.4915361602e-15 -5.4474005556e-15 6.408706535999999e-15 ] [ -7.850665506599998e-15 3.300483866039999e-14 9.613059803999998e-16 ] [ -3.012092071919999e-14 2.11487315688e-14 9.2926244772e-15 ] [ 1.95465549348e-14 -2.403264951e-14 3.5247885948e-15 ] [ 1.15356717648e-14 -3.66898449186e-14 1.2817413072e-15 ] [ 4.91868226638e-14 -2.37122141832e-14 -2.899939707539999e-14 ] [ -5.078899929779999e-14 3.572853893819999e-14 7.690447843199998e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.158644 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.550206165792429e-18 } }