{ "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" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4468601 -11.409587 1.4673874 ] [ -3.7237383 1.1415314 -3.2042108 ] [ -3.0186798 1.0651259 3.5354655 ] [ 6.5550353 10.1399847 -3.0889262 ] [ 0.9872771 -2.9677176 2.0473885 ] [ 0.2762647 -0.0779014 -1.4147186 ] [ 2.3707011 2.1085641 0.6576142 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.52247866738835e-09 -1.828017354438361e-08 2.351013785936498e-09 ] [ -5.966086446237536e-09 1.828934920989093e-09 -5.133711631874864e-09 ] [ -4.83645820124122e-09 1.706519815188559e-09 5.664440167744982e-09 ] [ 1.050232430617872e-08 1.62460464216097e-08 -4.949005341016586e-09 ] [ 1.581792287871224e-09 -4.754807755856686e-09 3.28027798839478e-09 ] [ 4.426248434923258e-10 -1.248118018075891e-10 -2.266629065930907e-09 ] [ 3.798281877324842e-09 3.378292104478194e-09 1.053614096746095e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.395808 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.986027377352561e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8048133 0.3576778 2.1248326 ] [ 1.301286 2.3291491 2.7299346 ] [ 1.6610495 2.6878709 5.0403626 ] [ 3.5680238 2.7488028 1.6348521 ] [ 3.0139036 0.7388882 5.4654464 ] [ 4.5210093 1.498537 3.6917364 ] [ 3.9092624 3.543761 4.8906102 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8048133e-10 3.576778e-11 2.1248326e-10 ] [ 1.301286e-10 2.3291491e-10 2.7299346e-10 ] [ 1.6610495e-10 2.6878709e-10 5.0403626e-10 ] [ 3.568023800000001e-10 2.7488028e-10 1.6348521e-10 ] [ 3.0139036e-10 7.388882000000001e-11 5.4654464e-10 ] [ 4.5210093e-10 1.498537e-10 3.6917364e-10 ] [ 3.9092624e-10 3.543761e-10 4.890610200000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.2e-06 6.89e-05 1.12e-05 ] [ 9.5e-06 3.99e-05 4.7e-06 ] [ 5.17e-05 -7.34e-05 -1.22e-05 ] [ -1.21e-05 -7.58e-05 3e-06 ] [ 4.04e-05 0.0001331 -5.95e-05 ] [ -2.41e-05 2.44e-05 6.22e-05 ] [ -6.01e-05 -0.0001171 -9.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.33131842816e-15 1.1038996917312e-13 1.794437815296e-14 ] [ 1.52206778976e-14 6.392684716992e-14 7.53023011776e-15 ] [ 8.283253129536002e-14 -1.1759976396672e-13 -1.954655477376e-14 ] [ -1.938633711168e-14 -1.2144498785664e-13 4.8065298624e-15 ] [ 6.472793548032e-14 2.1324970822848e-13 -9.532950893760001e-14 ] [ -3.861245656128e-14 3.909310954752e-14 9.965538581376e-14 ] [ -9.629081491008e-14 -1.8761488229568e-13 -1.490024257344e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.670886 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.670970379722203e-18 } }