{ "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" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4807634 -2.2399705 2.6462001 ] [ -1.0466195 1.8660793 -2.3320964 ] [ 6.551915 -1.7004237 -1.3738719 ] [ 4.7211115 7.0096956 4.0911875 ] [ -6.9636401 -2.5943302 -6.4686216 ] [ -3.9219989 -2.8124744 4.2273464 ] [ 2.1399955 0.4714238 -0.7901441 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.372444519962395e-09 -3.588828395949297e-09 4.239679969108464e-09 ] [ -1.676869307588763e-09 2.989788651651076e-09 -3.736430360315517e-09 ] [ 1.049732512095411e-08 -2.724379120039826e-09 -2.201185456289184e-09 ] [ 7.56405453180869e-09 1.123077050177261e-08 6.554805017812874e-09 ] [ -1.115698145580542e-08 -4.156575227320546e-09 -1.036387438170769e-08 ] [ -6.283734996153702e-09 -4.50608076740317e-09 6.772955625904017e-09 ] [ 3.428650786965146e-09 7.553041970714892e-10 -1.265950414512959e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.875968 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.062957506973171e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1773713 2.0829077 4.9512702 ] [ 2.2278045 3.6249371 2.8950824 ] [ 5.3282461 0.8955937 2.7992027 ] [ 4.9191085 3.3592291 2.8072619 ] [ 3.1638818 1.714567 1.5680336 ] [ 3.0628359 0.2758603 3.6959989 ] [ 3.80948 3.9951319 4.9523284 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1773713e-10 2.0829077e-10 4.9512702e-10 ] [ 2.2278045e-10 3.6249371e-10 2.8950824e-10 ] [ 5.328246100000001e-10 8.955937000000001e-11 2.7992027e-10 ] [ 4.919108500000001e-10 3.3592291e-10 2.8072619e-10 ] [ 3.1638818e-10 1.714567e-10 1.5680336e-10 ] [ 3.0628359e-10 2.758603e-11 3.6959989e-10 ] [ 3.80948e-10 3.9951319e-10 4.9523284e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.99e-05 2.8e-06 1.9e-06 ] [ 1.81e-05 -4.2e-06 -6.2e-06 ] [ -1.2e-06 -1.26e-05 1.58e-05 ] [ -5.8e-06 1.65e-05 8.4e-06 ] [ -2.26e-05 4.1e-06 -2.4e-06 ] [ 1.2e-06 -1.46e-05 -1.49e-05 ] [ -9.6e-06 8e-06 -2.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.18833150166e-14 4.486094575199999e-15 3.0441356046e-15 ] [ 2.899939707539999e-14 -6.729141862799999e-15 -9.9334951308e-15 ] [ -1.9226119608e-15 -2.01874255884e-14 2.53143908172e-14 ] [ -9.2926244772e-15 2.6435914461e-14 1.34582837256e-14 ] [ -3.62091919284e-14 6.568924199399999e-15 -3.845223921599999e-15 ] [ 1.9226119608e-15 -2.33917788564e-14 -2.38724318466e-14 ] [ -1.53808956864e-14 1.2817413072e-14 -4.3258769118e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.016851 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.726400105645953e-18 } }