{ "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" [ [ 0.921897 0.5298475 2.334561 ] [ 1.139586 1.500474 0.8908209 ] [ 1.083292 2.793611 2.25214 ] [ 2.326161 0.1583663 0.1821838 ] [ 2.280192 0.7456581 2.776174 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.21897e-11 5.298475e-11 2.334561e-10 ] [ 1.139586e-10 1.500474e-10 8.908209000000001e-11 ] [ 1.083292e-10 2.793611e-10 2.25214e-10 ] [ 2.326161e-10 1.583663e-11 1.821838e-11 ] [ 2.280192e-10 7.456581e-11 2.776174e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -146.7768036 -40.9181975 -27.9397882 ] [ -22.3007313 10.1420532 -37.8313517 ] [ -1.4590535 35.5978931 18.7285617 ] [ 19.0601822 -16.1564566 -10.854283 ] [ 151.4764061 11.3347078 57.8968611 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.35162365141127e-07 -6.55581799398972e-08 -4.476447581294891e-08 ] [ -3.572971060997244e-08 1.624936065782493e-08 -6.061250772637617e-08 ] [ -2.337661425455919e-09 5.703411254444982e-08 3.000646394416731e-08 ] [ 3.053777856062271e-08 -2.588549725275508e-08 -1.739047860142342e-08 ] [ 2.42691958455715e-07 1.816020399037754e-08 9.276099803636353e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 50.587448 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.105002715929003e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1729123 -0.0835639 2.558124 ] [ 0.5001615 1.5102427 0.5412555 ] [ 1.647108 3.1124477 2.2242518 ] [ 2.8306492 0.4078915 0.279122 ] [ 2.6002969 0.7809389 2.8331265 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.729123e-11 -8.35639e-12 2.558124e-10 ] [ 5.001615000000001e-11 1.5102427e-10 5.412555e-11 ] [ 1.647108e-10 3.1124477e-10 2.2242518e-10 ] [ 2.8306492e-10 4.078915e-11 2.79122e-11 ] [ 2.6002969e-10 7.809389000000001e-11 2.8331265e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.1e-06 2.82e-05 5.7e-06 ] [ -1.85e-05 -2.23e-05 -2.62e-05 ] [ 1.03e-05 -2.64e-05 4.51e-05 ] [ 1.72e-05 -1.3e-05 -3.1e-05 ] [ -1.31e-05 3.35e-05 6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.568924199399999e-15 4.51813810788e-14 9.1324068138e-15 ] [ -2.9640267729e-14 -3.572853893819999e-14 -4.197702781079999e-14 ] [ 1.65024193302e-14 -4.22974631376e-14 7.225816619339999e-14 ] [ 2.75574381048e-14 -2.082829624199999e-14 -4.966747565399999e-14 ] [ -2.09885139054e-14 5.367291723899999e-14 1.02539304576e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.588965 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.177192220324381e-18 } }