{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.0069015e-10 2.5744709e-10 1.1106721e-10 ] [ 2.6520223e-10 2.1321836e-10 5.1875845e-10 ] [ 1.1241076e-10 1.8275033e-10 3.2292232e-10 ] [ 2.4231508e-10 -1.534362e-11 3.9889574e-10 ] [ 3.3760643e-10 3.1416432e-10 3.0159204e-10 ] [ 4.5768258e-10 1.1043551e-10 3.7916025e-10 ] ] "source-value" [ [ 2.0069015 2.5744709 1.1106721 ] [ 2.6520223 2.1321836 5.1875845 ] [ 1.1241076 1.8275033 3.2292232 ] [ 2.4231508 -0.1534362 3.9889574 ] [ 3.3760643 3.1416432 3.0159204 ] [ 4.5768258 1.1043551 3.7916025 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -9.5297465405184e-13 3.31041733389696e-12 6.402618212040961e-12 ] [ -3.909310954752e-14 -2.169603492822528e-11 -6.366729455735041e-12 ] [ 1.176894858574848e-11 6.487052919957121e-12 -5.159970024948481e-12 ] [ 1.016533000598976e-11 1.370678120860608e-11 1.171960154582784e-11 ] [ -4.33244580030528e-12 -3.43282362772608e-12 -1.071968311678656e-11 ] [ -1.66097650278336e-11 1.6246070934912e-12 4.12416283960128e-12 ] ] "source-value" [ [ -0.0005948 0.0020662 0.0039962 ] [ -2.44e-05 -0.0135416 -0.0039738 ] [ 0.0073456 0.0040489 -0.0032206 ] [ 0.0063447 0.0085551 0.0073148 ] [ -0.0027041 -0.0021426 -0.0066907 ] [ -0.010367 0.001014 0.0025741 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.371517140419478e-18 "source-value" -21.043355 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.125445923145381e-09 5.841026467271386e-10 -1.756449566746184e-09 ] [ -6.006725976659452e-09 8.478363795152093e-09 1.937690621943698e-08 ] [ -6.274170590827789e-09 4.082496954836079e-09 -2.76786409369469e-09 ] [ -3.898799394378255e-09 -1.532972235884697e-08 -6.301183769307464e-09 ] [ -1.100356638351963e-09 8.904160336725509e-09 -7.812945878389492e-09 ] [ 1.840549852336284e-08 -6.719401214376183e-09 -7.384630715168179e-10 ] ] "source-value" [ [ -0.7024481 0.3645682 -1.0962896 ] [ -3.7491035 5.2917785 12.0941137 ] [ -3.9160293 2.5480942 -1.7275649 ] [ -2.4334392 -9.5680602 -3.9328896 ] [ -0.6867886 5.5575398 -4.8764573 ] [ 11.4878087 -4.1939204 -0.4609124 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.801814696942429e-18 "source-value" -17.487552 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.164327e-10 2.183765e-10 1.328393e-10 ] [ 2.70587e-10 2.068279e-10 5.162644000000001e-10 ] [ 8.559813e-11 1.907046e-10 3.441903e-10 ] [ 2.386273e-10 2.061938e-11 3.516969e-10 ] [ 3.489815e-10 3.035472e-10 2.979319e-10 ] [ 4.556806e-10 1.225964e-10 3.894732e-10 ] ] "source-value" [ [ 2.164327 2.183765 1.328393 ] [ 2.70587 2.068279 5.162644 ] [ 0.8559813 1.907046 3.441903 ] [ 2.386273 0.2061938 3.516969 ] [ 3.489815 3.035472 2.979319 ] [ 4.556806 1.225964 3.894732 ] ] } "instance-id" 1 }