{ "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" [ [ 1.291216 1.822107 1.800811 ] [ 1.534743 4.043561 0.7260553 ] [ 2.21799 3.847577 3.169656 ] [ 3.72216 2.8756 1.141297 ] [ 3.290513 5.175492 1.550965 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.291216e-10 1.822107e-10 1.800811e-10 ] [ 1.534743e-10 4.043561e-10 7.260553e-11 ] [ 2.21799e-10 3.847577e-10 3.169656e-10 ] [ 3.722160000000001e-10 2.8756e-10 1.141297e-10 ] [ 3.290513e-10 5.175492e-10 1.550965e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.5724625 1.3781685 0.127152 ] [ -4.6427212 -0.5055102 -3.4107866 ] [ -0.4978318 -2.7544259 2.0653342 ] [ -0.9144752 -3.9229303 1.2095926 ] [ 3.4825657 5.8046979 0.0087077 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.12153927538472e-09 2.208069350223005e-09 2.037199616879616e-10 ] [ -7.438459363532522e-09 -8.099166240159322e-10 -5.464682549057922e-09 ] [ -7.976144710507814e-10 -4.413076780705999e-09 3.309030169378671e-09 ] [ -1.465150785741404e-09 -6.28522721168793e-09 1.937980984412686e-09 ] [ 5.579685344939986e-09 9.300151266186857e-09 1.395127336094016e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -14.500486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323233965943771e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3694973 1.7540306 1.8103149 ] [ 1.4192103 4.0544251 0.686543 ] [ 2.1937029 3.786117 3.1326074 ] [ 3.6210574 2.8180629 1.2141211 ] [ 3.4531541 5.3517014 1.5451979 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3694973e-10 1.7540306e-10 1.8103149e-10 ] [ 1.4192103e-10 4.0544251e-10 6.86543e-11 ] [ 2.1937029e-10 3.786117e-10 3.1326074e-10 ] [ 3.621057400000001e-10 2.8180629e-10 1.2141211e-10 ] [ 3.4531541e-10 5.3517014e-10 1.5451979e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.27e-05 4.86e-05 -1.4e-06 ] [ 3.5e-06 -2.63e-05 2.04e-05 ] [ -1.24e-05 -1.66e-05 -1.6e-05 ] [ 1e-07 -2.52e-05 -5.5e-06 ] [ -3.9e-06 1.95e-05 2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.034764308416e-14 7.786578377088e-14 -2.24304726912e-15 ] [ 5.6076181728e-15 -4.213724512704e-14 3.268440306432e-14 ] [ -1.986699009792e-14 -2.659613190528e-14 -2.56348259328e-14 ] [ 1.6021766208e-16 -4.037485084416e-14 -8.8119714144e-15 ] [ -6.24848882112e-15 3.12424441056e-14 4.005441552e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.118168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.58241519397267e-18 } }