{ "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" [ [ 1.743709 2.680969 1.034902 ] [ 2.749822 1.528948 3.390438 ] [ 1.938557 3.742026 2.98984 ] [ 3.932402 1.721019 1.334077 ] [ 5.171354 1.721023 3.429234 ] [ 4.220666 3.803748 1.650722 ] [ 4.237092 3.532846 4.042988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.743709e-10 2.680969e-10 1.034902e-10 ] [ 2.749822e-10 1.528948e-10 3.390438e-10 ] [ 1.938557e-10 3.742026e-10 2.98984e-10 ] [ 3.932402e-10 1.721019e-10 1.334077e-10 ] [ 5.171354e-10 1.721023e-10 3.429234e-10 ] [ 4.220666e-10 3.803748e-10 1.650722e-10 ] [ 4.237092e-10 3.532846e-10 4.042988e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.0681924 -0.1846728 -4.0783158 ] [ -4.5500704 -6.0858795 4.0081165 ] [ -3.4993424 2.5096261 1.6263224 ] [ 1.1751498 -3.5394424 -4.5367646 ] [ 5.5251544 -4.3901412 2.6394808 ] [ 3.3210234 6.6265301 -3.3451154 ] [ 2.0962775 5.0639797 3.6862762 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.517962752196243e-09 -2.958784426576742e-10 -6.53418222699925e-09 ] [ -7.290016417874104e-09 -9.750653851905993e-09 6.421710549742724e-09 ] [ -5.606564581454163e-09 4.020864264369484e-09 2.605655727163346e-09 ] [ 1.882797535497796e-09 -5.670811863948242e-09 -7.268698176193063e-09 ] [ 8.852273205990252e-09 -7.033781592650858e-09 4.22891442881048e-09 ] [ 5.320866048609727e-09 1.061687160324749e-08 -5.359465687758041e-09 ] [ 3.358606801209072e-09 8.113389883545798e-09 5.906065545451465e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.1762596 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.470198859751156e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9684896 2.6221924 1.1707317 ] [ 2.4407149 1.1690871 4.0688168 ] [ 1.8960883 3.2841175 3.3445535 ] [ 4.1593577 2.0380707 1.0039949 ] [ 4.5614978 1.5215173 3.2496386 ] [ 4.8291857 4.1977297 1.430298 ] [ 4.1382679 3.8978642 3.6041675 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9684896e-10 2.6221924e-10 1.1707317e-10 ] [ 2.4407149e-10 1.1690871e-10 4.0688168e-10 ] [ 1.8960883e-10 3.2841175e-10 3.3445535e-10 ] [ 4.1593577e-10 2.0380707e-10 1.0039949e-10 ] [ 4.5614978e-10 1.5215173e-10 3.2496386e-10 ] [ 4.829185700000001e-10 4.1977297e-10 1.430298e-10 ] [ 4.1382679e-10 3.8978642e-10 3.6041675e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.5e-06 -1.58e-05 -4.4e-06 ] [ -1.2e-06 1.69e-05 1.04e-05 ] [ 4.8e-06 -3e-07 -1.58e-05 ] [ -6.9e-06 1.01e-05 -6.7e-06 ] [ -7e-07 -1.01e-05 -1.06e-05 ] [ -1.39e-05 -1.6e-06 8.1e-06 ] [ 1.05e-05 8e-07 1.91e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.2016324656e-14 -2.531439060864e-14 -7.04957713152e-15 ] [ -1.92261194496e-15 2.707678489152e-14 1.666263685632e-14 ] [ 7.69044777984e-15 -4.8065298624e-16 -2.531439060864e-14 ] [ -1.105501868352e-14 1.618198387008e-14 -1.073458335936e-14 ] [ -1.12152363456e-15 -1.618198387008e-14 -1.698307218048e-14 ] [ -2.227025502912e-14 -2.56348259328e-15 1.297763062848e-14 ] [ 1.68228545184e-14 1.28174129664e-15 3.060157345728e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.23956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.281429012247885e-18 } }