{ "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" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5894175 -1.948733 -2.3384604 ] [ 1.9985733 1.0735365 -0.1383587 ] [ -0.2736746 -0.8107753 0.1381773 ] [ -2.5657881 -1.1017963 -1.7024184 ] [ 0.6164082 2.0792758 1.9299347 ] [ -0.3696358 -0.859334 0.8461225 ] [ 2.1835345 1.5678264 1.2650029 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.546527559190384e-09 -3.122214452781447e-09 -3.746626581546617e-09 ] [ 3.202067416215105e-09 1.719995081875459e-09 -2.21675074424281e-10 ] [ -4.384750458267917e-10 -1.299005230382106e-09 2.213844395852679e-10 ] [ -4.110845707746852e-09 -1.765272272743943e-09 -2.727574959299743e-09 ] [ 9.875948069094105e-10 3.331367074955217e-09 3.092096256010662e-09 ] [ -5.922218369707047e-10 -1.376804844258547e-09 1.355637687832848e-09 ] [ 3.498407926610217e-09 2.511934803553029e-09 2.026758071624201e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.670605 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.151578344799158e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8395258 2.2270946 0.8519121 ] [ 2.0039504 1.3656052 2.8820515 ] [ 2.9166242 2.7083006 4.5055783 ] [ 4.1894102 0.7815874 2.1364747 ] [ 5.1020843 2.1242885 3.7599999 ] [ 3.5203343 4.3610787 1.1757725 ] [ 4.2288647 4.2710568 3.3233698 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8395258e-10 2.2270946e-10 8.519120999999999e-11 ] [ 2.0039504e-10 1.3656052e-10 2.8820515e-10 ] [ 2.9166242e-10 2.7083006e-10 4.5055783e-10 ] [ 4.1894102e-10 7.815874e-11 2.1364747e-10 ] [ 5.1020843e-10 2.1242885e-10 3.7599999e-10 ] [ 3.5203343e-10 4.3610787e-10 1.1757725e-10 ] [ 4.2288647e-10 4.2710568e-10 3.3233698e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.8e-06 -4.53e-05 2.38e-05 ] [ -4.6e-06 -5.6e-06 -3.93e-05 ] [ 6.8e-06 2.26e-05 1.9e-06 ] [ -9.9e-06 -1.49e-05 -2.6e-06 ] [ 1.64e-05 -9e-06 2.04e-05 ] [ -1.85e-05 5.9e-05 7.7e-06 ] [ 7.9e-06 -6.9e-06 -1.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.88391791744e-15 -7.257860092224001e-14 3.813180357504e-14 ] [ -7.370012455680001e-15 -8.972189076479999e-15 -6.296554119743999e-14 ] [ 1.089480102144e-14 3.620919163008e-14 3.04413557952e-15 ] [ -1.586154854592e-14 -2.387243164992e-14 -4.16565921408e-15 ] [ 2.627569658112e-14 -1.44195895872e-14 3.268440306432e-14 ] [ -2.96402674848e-14 9.45284206272e-14 1.233675998016e-14 ] [ 1.265719530432e-14 -1.105501868352e-14 -1.92261194496e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.529826 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.609676048789198e-18 } }