{ "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" [ [ 0.0066411 1.299857 0.8298456 ] [ 0.9999642 1.240181 2.737035 ] [ 2.654666 1.132969 0.0147569 ] [ 2.745471 0.2375767 2.196855 ] [ 1.997397 2.884463 1.181944 ] [ 2.106064 2.994709 2.966195 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.6411e-13 1.299857e-10 8.298456e-11 ] [ 9.999642e-11 1.240181e-10 2.737035e-10 ] [ 2.654666e-10 1.132969e-10 1.47569e-12 ] [ 2.745471000000001e-10 2.375767e-11 2.196855e-10 ] [ 1.997397e-10 2.884463e-10 1.181944e-10 ] [ 2.106064e-10 2.994709e-10 2.966195e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2823903 1.7775428 -1.871788 ] [ -2.2864709 -4.6487179 2.4170429 ] [ 2.9749225 -1.7506839 -2.5418995 ] [ 1.4380044 -2.6196455 0.3925598 ] [ -3.3550339 0.2587175 -12.7624876 ] [ 3.5109683 6.982787 14.3665724 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.656792378200698e-09 2.84793751663137e-09 -2.998934972693991e-09 ] [ -3.663330220119534e-09 -7.448067136074474e-09 3.872529625850632e-09 ] [ 4.766351278191888e-09 -2.804904814990966e-09 -4.07257195132321e-09 ] [ 2.303937030287531e-09 -4.197134774883927e-09 6.289501338259239e-10 ] [ -5.375356876571446e-09 4.14511129891824e-10 -2.04477592559699e-08 ] [ 5.625191326629921e-09 1.118765807942617e-08 2.301778642031055e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.378425 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.662806989572624e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3110928 1.5583486 0.9312424 ] [ 1.0714806 0.9726689 3.0984746 ] [ 3.1762828 1.1401892 0.366781 ] [ 2.7326833 -0.1428761 1.8778531 ] [ 1.9124868 3.0562376 0.8245669 ] [ 1.9283627 3.2051875 2.8277136 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.110928e-11 1.5583486e-10 9.312424e-11 ] [ 1.0714806e-10 9.726688999999999e-11 3.0984746e-10 ] [ 3.1762828e-10 1.1401892e-10 3.66781e-11 ] [ 2.7326833e-10 -1.428761e-11 1.8778531e-10 ] [ 1.9124868e-10 3.0562376e-10 8.245669000000001e-11 ] [ 1.9283627e-10 3.2051875e-10 2.8277136e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9e-06 -1.33e-05 -3e-07 ] [ -3.1e-06 -2.3e-06 -4.9e-06 ] [ -1.63e-05 -5.34e-05 3.94e-05 ] [ 1.4e-06 6.97e-05 -4.36e-05 ] [ 8e-07 5.4e-06 -1.93e-05 ] [ 8.3e-06 -6.1e-06 2.87e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.44195895872e-14 -2.130894905664e-14 -4.8065298624e-16 ] [ -4.96674752448e-15 -3.68500622784e-15 -7.850665441919999e-15 ] [ -2.611547891904e-14 -8.555623155072e-14 6.312575885952001e-14 ] [ 2.24304726912e-15 1.1167171046976e-13 -6.985490066688e-14 ] [ 1.28174129664e-15 8.65175375232e-15 -3.092200878144e-14 ] [ 1.329806595264e-14 -9.77327738688e-15 4.598246901696e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.973195 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.398970296767946e-18 } }