{ "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" [ [ 1.222424 2.904477 0.9358623 ] [ 1.494107 1.000567 2.599919 ] [ 2.753047 4.765039 1.902757 ] [ 2.502796 3.18307 3.733295 ] [ 3.53967 2.110225 1.931082 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222424e-10 2.904477e-10 9.358623e-11 ] [ 1.494107e-10 1.000567e-10 2.599919e-10 ] [ 2.753047e-10 4.765039e-10 1.902757e-10 ] [ 2.502796e-10 3.18307e-10 3.733295e-10 ] [ 3.53967e-10 2.110225e-10 1.931082e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7407237 1.0002569 -3.4591483 ] [ -2.4677818 -2.7007126 0.6139266 ] [ -0.5390345 2.4490096 -0.8529912 ] [ 0.0988755 1.9709038 5.9412361 ] [ 5.6486644 -2.7194577 -2.2430231 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.391123436212473e-09 1.602588219973883e-09 -5.542166534140064e-09 ] [ -3.953822305195741e-09 -4.327018587219982e-09 9.836188454072333e-10 ] [ -8.636284737046176e-10 3.92374592523476e-09 -1.366642558388137e-09 ] [ 1.584160144699104e-10 3.157735990205879e-09 9.51890957807297e-09 ] [ 9.05015804042526e-09 -4.357051548194541e-09 -3.59371917073434e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.1710072 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.469357332502847e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9035519 3.0451972 0.9923693 ] [ 1.7213761 1.2950949 2.5744468 ] [ 2.8834522 4.2902513 1.8667189 ] [ 2.0804445 3.3027728 4.0149117 ] [ 3.9232193 2.0300618 1.6544685 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.035519e-11 3.0451972e-10 9.923693000000001e-11 ] [ 1.7213761e-10 1.2950949e-10 2.5744468e-10 ] [ 2.8834522e-10 4.2902513e-10 1.8667189e-10 ] [ 2.0804445e-10 3.3027728e-10 4.0149117e-10 ] [ 3.9232193e-10 2.0300618e-10 1.6544685e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 -1.31e-05 -1.69e-05 ] [ -1.56e-05 -4.76e-05 -5.4e-06 ] [ 5.7e-06 6.06e-05 7.6e-06 ] [ 3.17e-05 9.1e-06 -3.7e-06 ] [ -2.17e-05 -9e-06 1.84e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-16 -2.098851373248e-14 -2.707678489152e-14 ] [ -2.499395528448e-14 -7.626360715008e-14 -8.65175375232e-15 ] [ 9.13240673856e-15 9.709190322048001e-14 1.217654231808e-14 ] [ 5.078899887936e-14 1.457980724928e-14 -5.928053496960001e-15 ] [ -3.476723267136e-14 -1.44195895872e-14 2.948004982272e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }