{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.62041 2.509202 2.566624 ] [ 2.85955 3.94705 0.1409863 ] [ 3.121365 1.927989 0.779992 ] [ 4.065015 5.453159 1.199522 ] [ 3.840762 3.584521 2.337034 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.62041e-10 2.509202e-10 2.566624e-10 ] [ 2.85955e-10 3.94705e-10 1.409863e-11 ] [ 3.121365e-10 1.927989e-10 7.79992e-11 ] [ 4.065015e-10 5.453159000000001e-10 1.199522e-10 ] [ 3.840762e-10 3.584521e-10 2.337034e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.945653 -0.4800753 3.3527053 ] [ -3.7369964 3.0705448 -10.4164293 ] [ 1.3066512 -3.9694024 -3.019419 ] [ 0.345346 2.0522636 -0.3358116 ] [ 6.0306522 -0.6733306 10.4189546 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.321633042472001e-09 -7.691654282205401e-10 5.37162609234796e-09 ] [ -5.987328313422118e-09 4.919555132210203e-09 -1.668895963417298e-08 ] [ 2.09348602142806e-09 -6.359683776223521e-09 -4.837642570055646e-09 ] [ 5.53305291845364e-10 3.288088786728722e-09 -5.380294989461543e-10 ] [ 9.662170042620693e-09 -1.0787945542772e-09 1.669300561082681e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.7961581 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.286469074789835e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.404936 2.5134945 2.7097863 ] [ 2.7758186 4.0377141 -0.5179747 ] [ 3.1424571 2.0517212 0.9088099 ] [ 3.9024788 5.4589258 1.3006796 ] [ 4.2814115 3.3600653 2.6228572 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.404936e-10 2.5134945e-10 2.7097863e-10 ] [ 2.7758186e-10 4.0377141e-10 -5.179747e-11 ] [ 3.1424571e-10 2.0517212e-10 9.088099e-11 ] [ 3.9024788e-10 5.458925800000001e-10 1.3006796e-10 ] [ 4.2814115e-10 3.3600653e-10 2.6228572e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.6e-06 -2e-06 3.6e-06 ] [ -3.5e-06 -4.6e-06 -1.11e-05 ] [ 1.3e-06 5.1e-06 6e-07 ] [ 3.1e-06 6.2e-06 4.2e-06 ] [ 1.7e-06 -4.6e-06 2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.165659248399999e-15 -3.204353268e-15 5.767835882399999e-15 ] [ -5.607618218999999e-15 -7.370012516399999e-15 -1.77841606374e-14 ] [ 2.0828296242e-15 8.1711008334e-15 9.613059803999998e-16 ] [ 4.9667475654e-15 9.9334951308e-15 6.729141862799999e-15 ] [ 2.7237002778e-15 -7.370012516399999e-15 4.486094575199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.382973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.823753336605288e-18 } }