{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0647644 0.143829 0.6473224 ] [ 1.313892 1.683397 0.0769283 ] [ 0.1194939 2.399252 1.546304 ] [ 2.728192 0.2406182 0.1106797 ] [ 2.458193 2.956348 2.547264 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.47644e-12 1.43829e-11 6.473223999999999e-11 ] [ 1.313892e-10 1.683397e-10 7.69283e-12 ] [ 1.194939e-11 2.399252e-10 1.546304e-10 ] [ 2.728192e-10 2.406182e-11 1.106797e-11 ] [ 2.458193e-10 2.956348e-10 2.547264000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.9277589 -6.0035098 0.1452137 ] [ 1.2373994 3.6263613 -5.4655553 ] [ -5.165429 4.0708736 3.4334439 ] [ 5.742234 -4.189734 -1.4528827 ] [ 3.1135544 2.4960089 3.3397804 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.895140102519125e-09 -9.618683044303684e-09 2.326579951598649e-10 ] [ 1.982532389271947e-09 5.810071293433896e-09 -8.756784921349531e-09 ] [ -8.275929580202322e-09 6.52225850815193e-09 5.500983545408373e-09 ] [ 9.200073065962868e-09 -6.712693862170866e-09 -2.32777469470478e-09 ] [ 4.988464067268971e-09 3.999047104888725e-09 5.350918075486072e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 28.512494 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.568205128750028e-18 } "relaxed-configuration-positions" { "source-value" [ [ -1.8372472 -2.5462112 0.6464251 ] [ 1.4042921 3.5860262 -2.9403899 ] [ -2.7861904 4.3172338 3.0990009 ] [ 5.4408122 -1.875891 -0.1301192 ] [ 4.4628686 3.9422863 4.2535816 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.8372472e-10 -2.5462112e-10 6.464251e-11 ] [ 1.4042921e-10 3.5860262e-10 -2.9403899e-10 ] [ -2.7861904e-10 4.3172338e-10 3.0990009e-10 ] [ 5.4408122e-10 -1.875891e-10 -1.301192e-11 ] [ 4.4628686e-10 3.9422863e-10 4.2535816e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 0.0 0.0 ] [ 0.0 0.0 -0.0 ] [ 0.0 -0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.846037335159101e-34 } }