{ "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" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0141758 0.0971797 -1.3901828 ] [ 2.1894384 2.7264106 0.5398156 ] [ -1.2384566 -2.3819248 -1.2632627 ] [ -0.1846706 -2.1389111 -1.0284348 ] [ 0.4569468 0.0476089 0.7948381 ] [ -1.8090976 1.6348688 0.865386 ] [ 0.6000155 0.014768 1.4818406 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.27121355282572e-11 1.556990446391298e-10 -2.227318399148695e-09 ] [ 3.507867046062345e-09 4.36819135800992e-09 8.648799409886903e-10 ] [ -1.984226226743084e-09 -3.816264258505123e-09 -2.023969980543752e-09 ] [ -2.958749203067604e-10 -3.426913386623237e-09 -1.647734206152463e-09 ] [ 7.321094859410711e-10 7.627786715044259e-11 1.273471031632955e-09 ] [ -2.898493903345478e-09 2.619348591015619e-09 1.386501228590724e-09 ] [ 9.61330814137827e-10 2.3660944530912e-11 2.37417038463254e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.14895306491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.587347526417173e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4314705 2.2945633 1.8504583 ] [ 2.7647132 4.8710089 4.0924312 ] [ 1.1092508 3.22071 3.5903873 ] [ 4.7097136 2.5635363 1.2186707 ] [ 3.4011817 2.3438805 4.1307935 ] [ 3.2988708 4.6426559 1.6553777 ] [ 5.2439146 3.7156352 3.2463644 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4314705e-10 2.2945633e-10 1.8504583e-10 ] [ 2.7647132e-10 4.871008899999999e-10 4.0924312e-10 ] [ 1.1092508e-10 3.22071e-10 3.5903873e-10 ] [ 4.7097136e-10 2.5635363e-10 1.2186707e-10 ] [ 3.4011817e-10 2.3438805e-10 4.1307935e-10 ] [ 3.2988708e-10 4.6426559e-10 1.6553777e-10 ] [ 5.243914600000001e-10 3.7156352e-10 3.2463644e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.82e-05 1.35e-05 -1.7e-05 ] [ -8.8e-06 2.49e-05 1.4e-05 ] [ -5.5e-06 -1.59e-05 8.7e-06 ] [ 1.32e-05 -1.26e-05 1.67e-05 ] [ 1.1e-05 -1.36e-05 -2e-07 ] [ -2.67e-05 1.76e-05 -3.75e-05 ] [ 3.51e-05 -1.39e-05 1.53e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.915961473879999e-14 2.162938455899999e-14 -2.723700277799999e-14 ] [ -1.40991543792e-14 3.989419818659999e-14 2.243047287599999e-14 ] [ -8.811971486999999e-15 -2.54746084806e-14 1.39389367158e-14 ] [ 2.11487315688e-14 -2.01874255884e-14 2.67563497878e-14 ] [ 1.7623942974e-14 -2.17896022224e-14 -3.204353268e-16 ] [ -4.277811612779999e-14 2.81983087584e-14 -6.008162377499999e-14 ] [ 5.62363998534e-14 -2.22702552126e-14 2.45133025002e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.14226006491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.906710516396036e-18 } }