{ "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" [ [ 1.888839 2.682802 2.483288 ] [ 4.584027 1.697115 1.780244 ] [ 5.622084 2.160801 4.094107 ] [ 3.250182 0.9950144 3.979579 ] [ 5.691266 3.575432 2.207922 ] [ 3.710937 3.502612 1.042458 ] [ 3.524601 3.924526 3.14177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.888839e-10 2.682802e-10 2.483288e-10 ] [ 4.584027e-10 1.697115e-10 1.780244e-10 ] [ 5.622084000000001e-10 2.160801e-10 4.094107000000001e-10 ] [ 3.250182e-10 9.950144e-11 3.979579e-10 ] [ 5.691266e-10 3.575432e-10 2.207922e-10 ] [ 3.710937e-10 3.502612e-10 1.042458e-10 ] [ 3.524601e-10 3.924526e-10 3.14177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4637713 -2.5815341 -0.0280161 ] [ -0.36778 -4.4006246 1.6508453 ] [ -2.7649013 -0.2818305 -0.8915839 ] [ 1.3049868 3.1168208 -2.1147493 ] [ 2.0807662 1.3935849 0.5189163 ] [ -2.0264284 1.5662408 -3.5569302 ] [ 1.3095855 1.1873428 4.421518 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.43043534258023e-10 -4.13607358081797e-09 -4.488674042599488e-11 ] [ -5.89248517597824e-10 -7.050577851037353e-09 2.644945744217562e-09 ] [ -4.429860221679527e-09 -4.515422381283744e-10 -1.428474880061685e-09 ] [ 2.090819341412605e-09 4.993697416983153e-09 -3.388201887313166e-09 ] [ 3.333754958990857e-09 2.232769145879906e-09 8.313955640120391e-10 ] [ -3.246696206205151e-09 2.509394392303089e-09 -5.698830408257469e-09 ] [ 2.098187271038679e-09 1.90233287503521e-09 7.084052768046374e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.760699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.607971953566594e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1972254 2.3524637 2.2214821 ] [ 4.4936678 1.3001499 1.709576 ] [ 5.4171816 2.2090435 3.9375986 ] [ 3.2892315 1.4588232 3.9827225 ] [ 5.6403212 3.566339 2.1484659 ] [ 3.6502799 3.6549768 1.0878485 ] [ 3.5840285 3.9965063 3.6416745 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1972254e-10 2.3524637e-10 2.2214821e-10 ] [ 4.4936678e-10 1.3001499e-10 1.709576e-10 ] [ 5.4171816e-10 2.2090435e-10 3.9375986e-10 ] [ 3.2892315e-10 1.4588232e-10 3.9827225e-10 ] [ 5.6403212e-10 3.566339e-10 2.1484659e-10 ] [ 3.6502799e-10 3.6549768e-10 1.0878485e-10 ] [ 3.5840285e-10 3.9965063e-10 3.6416745e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-06 -9e-06 7e-06 ] [ -2.9e-06 7.9e-06 -1.01e-05 ] [ -2.9e-06 4e-07 -8e-07 ] [ 1e-06 3.9e-06 4e-07 ] [ 8.4e-06 -4.6e-06 1.14e-05 ] [ -3.5e-06 -2.1e-06 -8e-07 ] [ 1e-06 3.5e-06 -7.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76239428288e-15 -1.44195895872e-14 1.12152363456e-14 ] [ -4.646312200320001e-15 1.265719530432e-14 -1.618198387008e-14 ] [ -4.646312200320001e-15 6.408706483200001e-16 -1.28174129664e-15 ] [ 1.6021766208e-15 6.24848882112e-15 6.408706483200001e-16 ] [ 1.345828361472e-14 -7.370012455680001e-15 1.826481347712e-14 ] [ -5.6076181728e-15 -3.36457090368e-15 -1.28174129664e-15 ] [ 1.6021766208e-15 5.6076181728e-15 -1.169588933184e-14 ] ] } "relaxed-potential-energy" { "source-value" -32.399964 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.191046483556165e-18 } }