{ "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" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4938011 0.8363815 -2.6323474 ] [ 4.1899874 0.8490444 1.2930306 ] [ -2.1220571 0.605389 -1.5016665 ] [ -0.6396439 1.9801065 -0.0398551 ] [ -3.276973 -2.5238661 0.3938329 ] [ -0.1214767 0.448058 1.8845204 ] [ 0.4763623 -2.1951134 0.6024851 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.393333198545323e-09 1.340030885369635e-09 -4.217485462103666e-09 ] [ 6.713099853726578e-09 1.360319087701164e-09 2.071663397298997e-09 ] [ -3.399910273622648e-09 9.69940102289491e-10 -2.405934958538563e-09 ] [ -1.024822502217333e-09 3.172480340994116e-09 -6.385490943964607e-11 ] [ -5.250289527592838e-09 -4.043679259449675e-09 6.309898648818643e-10 ] [ -1.946271287119354e-10 7.178680523624064e-10 3.019334526300665e-09 ] [ 7.632165400905159e-10 -3.516959369484799e-09 9.652875416003501e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -27.598603 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.421783649334074e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9654565 2.0511877 1.2149074 ] [ 2.2382774 1.7922473 3.6231923 ] [ 2.2404566 4.017739 2.628959 ] [ 3.3938065 0.2835415 2.0967988 ] [ 4.1577474 2.597986 2.1293425 ] [ 4.551575 1.1576269 4.0558893 ] [ 3.8387657 3.4654878 4.3847827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9654565e-10 2.0511877e-10 1.2149074e-10 ] [ 2.2382774e-10 1.7922473e-10 3.6231923e-10 ] [ 2.2404566e-10 4.017739e-10 2.628959e-10 ] [ 3.3938065e-10 2.835415e-11 2.0967988e-10 ] [ 4.1577474e-10 2.597986e-10 2.1293425e-10 ] [ 4.551575e-10 1.1576269e-10 4.0558893e-10 ] [ 3.8387657e-10 3.4654878e-10 4.3847827e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-07 2.6e-06 -1.9e-06 ] [ -9.3e-06 -2.3e-06 2.2e-06 ] [ 1.7e-06 -3e-07 -9e-07 ] [ 6e-07 -2.4e-06 -2e-06 ] [ -3.1e-06 2.5e-06 -1.1e-06 ] [ 7.6e-06 -3.1e-06 4.7e-06 ] [ 1.9e-06 3e-06 -1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.6130597248e-16 4.16565921408e-15 -3.04413557952e-15 ] [ -1.490024257344e-14 -3.68500622784e-15 3.52478856576e-15 ] [ 2.72370025536e-15 -4.8065298624e-16 -1.44195895872e-15 ] [ 9.6130597248e-16 -3.84522388992e-15 -3.2043532416e-15 ] [ -4.96674752448e-15 4.005441552e-15 -1.76239428288e-15 ] [ 1.217654231808e-14 -4.96674752448e-15 7.53023011776e-15 ] [ 3.04413557952e-15 4.8065298624e-15 -1.6021766208e-15 ] ] } "relaxed-potential-energy" { "source-value" -31.275942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.010958306589679e-18 } }