{ "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" [ [ 1.08267 0.385996 1.67532 ] [ 0.7413004 2.189146 0.0242846 ] [ 0.0452684 1.636125 2.5153 ] [ 2.351375 1.598321 0.2166547 ] [ 2.147702 1.718144 2.949578 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08267e-10 3.85996e-11 1.67532e-10 ] [ 7.413004e-11 2.189146e-10 2.42846e-12 ] [ 4.52684e-12 1.636125e-10 2.5153e-10 ] [ 2.351375e-10 1.598321e-10 2.166547e-11 ] [ 2.147702e-10 1.718144e-10 2.949578e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6173977 -14.6286434 -2.5895547 ] [ -11.6190312 7.5973436 -6.3308041 ] [ -11.0439296 6.0571745 5.2649264 ] [ 13.4337081 -2.4122262 -2.8551596 ] [ 7.6118551 3.3863515 6.510592 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.591356781475692e-09 -2.343767044950022e-08 -4.148923998622758e-09 ] [ -1.861574014498577e-08 1.217228629610451e-08 -1.014306631988479e-08 ] [ -1.769432580688109e-08 9.70466337200593e-09 8.43534198831271e-09 ] [ 2.152317304847159e-08 -3.864812421721225e-09 -4.57446995977268e-09 ] [ 1.219553628213724e-08 5.425533203111011e-09 1.043111828996751e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.5768173 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.52633981333298e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0293206 -0.304872 1.4267543 ] [ 0.4903985 2.5681763 0.2124649 ] [ -0.0026328 1.6528084 2.3910707 ] [ 2.5499578 1.3582985 0.5613706 ] [ 2.3012718 2.2533208 2.7894768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0293206e-10 -3.04872e-11 1.4267543e-10 ] [ 4.903985e-11 2.5681763e-10 2.124649e-11 ] [ -2.6328e-13 1.6528084e-10 2.3910707e-10 ] [ 2.5499578e-10 1.3582985e-10 5.613706000000001e-11 ] [ 2.3012718e-10 2.2533208e-10 2.7894768e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.22e-05 -7.36e-05 -3.19e-05 ] [ -2.1e-06 2.98e-05 -2.68e-05 ] [ -3.42e-05 -1.32e-05 2.78e-05 ] [ 9.3e-06 -6.8e-06 1.42e-05 ] [ 4.92e-05 6.37e-05 1.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.556832098176e-14 -1.1792019929088e-13 -5.110943420352001e-14 ] [ -3.36457090368e-15 4.774486329984001e-14 -4.293833343744e-14 ] [ -5.479444043136e-14 -2.114873139456e-14 4.454051005824e-14 ] [ 1.490024257344e-14 -1.089480102144e-14 2.275090801536e-14 ] [ 7.882708974336e-14 1.0205865074496e-13 2.675634956736e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.3509582 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.337970998931805e-18 } }