{ "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" [ [ 2.930378 5.180054 2.851976 ] [ 5.738994 3.052967 1.218676 ] [ 3.217774 2.94037 2.40806 ] [ 5.439965 2.572298 3.526756 ] [ 4.050256 4.656384 1.057411 ] [ 5.133306 4.977378 3.451883 ] [ 3.497867 4.079859 4.731393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.930378e-10 5.180054e-10 2.851976e-10 ] [ 5.738994e-10 3.052967000000001e-10 1.218676e-10 ] [ 3.217774e-10 2.94037e-10 2.40806e-10 ] [ 5.439965e-10 2.572298e-10 3.526756e-10 ] [ 4.050256e-10 4.656384e-10 1.057411e-10 ] [ 5.133306e-10 4.977378e-10 3.451883e-10 ] [ 3.497867e-10 4.079859e-10 4.731393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.8445367 5.3048369 0.8874706 ] [ 0.4287606 -0.4046693 -0.0433172 ] [ -1.0611978 -3.9327534 0.1472092 ] [ 0.8523045 -0.0144641 -0.4417608 ] [ 2.5165646 0.2868036 -5.5192092 ] [ 4.6487528 0.8331624 0.1661334 ] [ -1.540648 -2.0729161 4.8034739 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.363980137295467e-09 8.499285728360993e-09 1.42188465868196e-09 ] [ 6.869502148998203e-10 -6.483516969571362e-10 -6.94018056903048e-11 ] [ -1.700226319212205e-09 -6.300965604764055e-09 2.358551405498328e-10 ] [ 1.365542354953053e-09 -2.31740430518394e-11 -7.077788315771471e-10 ] [ 4.031981000071556e-09 4.595100264670823e-10 -8.842748018397831e-09 ] [ 7.448123113402074e-09 1.334873329607361e-09 2.661750516069755e-10 ] [ -2.468390226818832e-09 -3.321177739662407e-09 7.696013644608852e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.026547 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.92686525911028e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8136568 5.2871229 2.868688 ] [ 5.7511434 3.0410193 1.2174011 ] [ 3.1931087 2.8640157 2.4086788 ] [ 5.4626682 2.5722163 3.5152415 ] [ 4.0974775 4.6618073 0.9428866 ] [ 5.2247493 4.993338 3.4605693 ] [ 3.4657362 4.0397904 4.8326896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8136568e-10 5.2871229e-10 2.868688e-10 ] [ 5.7511434e-10 3.0410193e-10 1.2174011e-10 ] [ 3.1931087e-10 2.8640157e-10 2.4086788e-10 ] [ 5.4626682e-10 2.5722163e-10 3.5152415e-10 ] [ 4.0974775e-10 4.661807300000001e-10 9.428866000000001e-11 ] [ 5.2247493e-10 4.993337999999999e-10 3.4605693e-10 ] [ 3.4657362e-10 4.039790400000001e-10 4.8326896e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.2244968 1.2226102 0.1191289 ] [ 0.4152171 -0.4380277 -0.0773597 ] [ -0.5785295 -0.6232701 -0.210165 ] [ 0.7562853 0.0266238 -0.3507678 ] [ 0.2637203 -0.0079374 -1.6090631 ] [ 0.846255 0.1020321 0.5895067 ] [ -0.4784513 -0.2820309 1.5387201 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.961860161367771e-09 1.958837494930067e-09 1.908655400141226e-10 ] [ 6.652511356572413e-10 -7.017977459847617e-10 -1.239439037532498e-10 ] [ -9.26906446979703e-10 -9.985887908908433e-10 -3.3672145228461e-10 ] [ 1.21170263629768e-09 4.265603026828919e-11 -5.619919731195851e-10 ] [ 4.225265025714702e-10 -1.27171168147116e-11 -2.578003301451605e-09 ] [ 1.35584998740567e-09 1.634734465379514e-10 9.444938603264478e-10 ] [ -7.665634933669241e-10 -4.518633180459905e-10 2.465301390486143e-09 ] ] } "relaxed-potential-energy" { "source-value" -14.019999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.246251480650337e-18 } }