{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3138196 2.289741 1.3599303 ] [ -1.7926834 -7.2242029 -0.5062243 ] [ -7.2427208 -1.9823112 -0.6368523 ] [ 3.3980981 7.4684796 3.0214465 ] [ -2.7194698 -0.8223582 -1.3575477 ] [ 4.0603069 2.31425 0.137142 ] [ 1.9826494 -2.0435984 -2.0178945 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.707147698411226e-09 3.668569528111793e-09 2.17884855052861e-09 ] [ -2.872195455639676e-09 -1.157444908565504e-08 -8.110607450230061e-10 ] [ -1.160411803234578e-08 -3.1760126859565e-09 -1.020349874369158e-09 ] [ 5.444353375859794e-09 1.196582350662566e-08 4.840890983181081e-09 ] [ -4.357070970428653e-09 -1.317563092818299e-09 -2.175031204480442e-09 ] [ 6.505328842048974e-09 3.707837275234499e-09 2.19725707940028e-10 ] [ 3.176554542094119e-09 -3.274205605759785e-09 -3.233023417777113e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.580134 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.656430328338896e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.4841171 1.4119126 1.8602104 ] [ 1.8898821 2.3552978 3.4367404 ] [ 1.506965 4.185691 1.8805095 ] [ 3.1091773 4.5314884 3.7946577 ] [ 4.3202155 2.4491686 3.8644833 ] [ 3.7529899 5.1605855 1.5592029 ] [ 3.1162442 3.1704206 0.3651014 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.4841171e-10 1.4119126e-10 1.8602104e-10 ] [ 1.8898821e-10 2.3552978e-10 3.4367404e-10 ] [ 1.506965e-10 4.185691000000001e-10 1.8805095e-10 ] [ 3.1091773e-10 4.5314884e-10 3.7946577e-10 ] [ 4.3202155e-10 2.4491686e-10 3.8644833e-10 ] [ 3.7529899e-10 5.1605855e-10 1.5592029e-10 ] [ 3.1162442e-10 3.1704206e-10 3.651014e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 2.3e-06 -2.32e-05 ] [ -1.23e-05 -2.9e-05 1.71e-05 ] [ 6.6e-06 8.6e-06 -1.2e-06 ] [ 1.16e-05 -1.21e-05 1.67e-05 ] [ -1.64e-05 3.46e-05 4.3e-06 ] [ 1.07e-05 3.3e-06 -1.72e-05 ] [ 3e-07 -7.7e-06 3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706536e-16 3.685006258199999e-15 -3.71704979088e-14 ] [ -1.97067725982e-14 -4.6463122386e-14 2.73972204414e-14 ] [ 1.05743657844e-14 1.37787190524e-14 -1.9226119608e-15 ] [ 1.85852489544e-14 -1.93863372714e-14 2.67563497878e-14 ] [ -2.62756967976e-14 5.54353115364e-14 6.8893595262e-15 ] [ 1.71432899838e-14 5.2871828922e-15 -2.75574381048e-14 ] [ 4.806529901999999e-16 -1.23367600818e-14 5.4474005556e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.946238 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.516174972780289e-18 } }