{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.247505 0.2174365 0.42208 ] [ 0.0506875 0.0915851 2.362651 ] [ 1.429891 2.603248 1.463699 ] [ 0.6097234 2.164425 2.912732 ] [ 2.744149 0.6540612 0.6213704 ] [ 2.652131 2.68783 0.0915898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.247505e-10 2.174365e-11 4.2208e-11 ] [ 5.068750000000001e-12 9.15851e-12 2.362651e-10 ] [ 1.429891e-10 2.603248e-10 1.463699e-10 ] [ 6.097234e-11 2.164425e-10 2.912732e-10 ] [ 2.744149e-10 6.540612e-11 6.213704e-11 ] [ 2.652131e-10 2.68783e-10 9.15898e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -57.4957273 -21.3126493 -14.6380599 ] [ -4.4341776 -6.4697933 2.8511067 ] [ 15.1087155 16.2542919 -30.1764111 ] [ -22.6525127 -4.5723033 44.0129866 ] [ 62.6723021 4.6497264 8.9220555 ] [ 6.8014 11.4507276 -10.9716777 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.21183108348959e-08 -3.414662871709645e-08 -2.345275753887237e-08 ] [ -7.104335741726198e-09 -1.036575165206975e-08 4.567976535780848e-09 ] [ 2.420683094385363e-08 2.604224668439546e-08 -4.834794076239823e-08 ] [ -3.629332654932825e-08 -7.325637510821091e-09 7.05165787230751e-08 ] [ 1.004120980236091e-07 7.449682992572936e-09 1.429470884935119e-08 ] [ 1.08970441584876e-08 1.83460882030189e-08 -1.757856564671886e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 25.879637 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.146374969780185e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5788057 0.389294 0.2067607 ] [ 0.6138138 -0.0677197 2.6227208 ] [ 0.6781294 2.820552 0.6757224 ] [ 0.7123395 2.3434589 3.0878111 ] [ 3.026247 0.2609088 0.4080176 ] [ 3.1247515 2.6720918 0.8730897 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.788057e-11 3.89294e-11 2.067607e-11 ] [ 6.138138e-11 -6.771969999999999e-12 2.6227208e-10 ] [ 6.781294e-11 2.820552e-10 6.757223999999999e-11 ] [ 7.123395e-11 2.3434589e-10 3.0878111e-10 ] [ 3.026247e-10 2.609088e-11 4.080176e-11 ] [ 3.1247515e-10 2.6720918e-10 8.730897e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.9e-05 -5.05e-05 -5.12e-05 ] [ 3.65e-05 3.5e-06 7.3e-06 ] [ -2.5e-06 2.21e-05 -9e-06 ] [ 6.5e-06 1.39e-05 7.1e-06 ] [ -9.3e-06 4.1e-06 1.2e-05 ] [ 1.78e-05 6.9e-06 3.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.850665506599998e-14 -8.090992001699999e-14 -8.20314436608e-14 ] [ 5.847944714099999e-14 5.607618218999999e-15 1.16958894282e-14 ] [ -4.005441585e-15 3.54081036114e-14 -1.4419589706e-14 ] [ 1.0414148121e-14 2.22702552126e-14 1.13754541014e-14 ] [ -1.49002426962e-14 6.568924199399999e-15 1.9226119608e-14 ] [ 2.851874408519999e-14 1.10550187746e-14 5.415357022919999e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.005221 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.564319110820611e-18 } }