{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.700341 1.969723 2.203994 ] [ 1.820171 2.226461 4.644887 ] [ 1.683397 4.142957 3.874532 ] [ 4.686676 2.237231 1.35428 ] [ 4.257123 2.593073 3.820407 ] [ 3.357584 4.187851 2.029918 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700341e-10 1.969723e-10 2.203994e-10 ] [ 1.820171e-10 2.226461e-10 4.644887e-10 ] [ 1.683397e-10 4.142957e-10 3.874532e-10 ] [ 4.686676000000001e-10 2.237231e-10 1.35428e-10 ] [ 4.257123e-10 2.593073e-10 3.820407e-10 ] [ 3.357584e-10 4.187851e-10 2.029918e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.0567475 -8.9621236 -3.0610572 ] [ 0.8343231 -5.5518009 1.9922729 ] [ -2.5228481 10.1419922 0.737851 ] [ 5.7708499 -0.4981429 -3.1760921 ] [ 2.349819 0.1370252 3.6571402 ] [ -0.3753964 4.7330499 -0.1501148 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.70397924258885e-09 -1.435890490463993e-08 -4.90435428077151e-09 ] [ 1.336732965013381e-09 -8.8949656053164e-09 3.191973062633416e-09 ] [ -4.042048243649701e-09 1.624926279117596e-08 1.182167621833901e-09 ] [ 9.245920791926018e-09 -7.981129081975123e-10 -5.088660508127575e-09 ] [ 3.764825064911636e-09 2.195385719004442e-10 5.859384527427836e-09 ] [ -6.014513356124851e-10 7.583181894859778e-09 -2.405104229960678e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.077817 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.614644278610079e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2960462 1.7125039 1.8932977 ] [ 2.1719607 2.2114962 4.3046894 ] [ 1.4962211 4.4976142 3.9514066 ] [ 4.7614892 2.0923578 1.5446367 ] [ 4.5655567 2.7057551 3.9797172 ] [ 3.2140181 4.1375689 2.2542705 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2960462e-10 1.7125039e-10 1.8932977e-10 ] [ 2.1719607e-10 2.2114962e-10 4.3046894e-10 ] [ 1.4962211e-10 4.4976142e-10 3.9514066e-10 ] [ 4.7614892e-10 2.0923578e-10 1.5446367e-10 ] [ 4.5655567e-10 2.7057551e-10 3.9797172e-10 ] [ 3.2140181e-10 4.1375689e-10 2.2542705e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.22e-05 0.0001272 -0.0001355 ] [ -0.0003148 -0.00015 0.0004133 ] [ 9.54e-05 -0.0001694 -2.18e-05 ] [ 2.45e-05 -4.5e-06 -2.41e-05 ] [ 6.66e-05 0.0001669 -5.32e-05 ] [ 0.0001505 2.98e-05 -0.0001786 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.556832098176e-14 2.0379686616576e-13 -2.170949321184e-13 ] [ -5.0436520022784e-13 -2.4032649312e-13 6.6217959737664e-13 ] [ 1.5284764962432e-13 -2.7140871956352e-13 -3.492745033344e-14 ] [ 3.92533272096e-14 -7.2097947936e-15 -3.861245656128e-14 ] [ 1.0670496294528e-13 2.6740327801152e-13 -8.523579622656e-14 ] [ 2.411275814304e-13 4.774486329984001e-14 -2.8614874447488e-13 ] ] } "relaxed-potential-energy" { "source-value" -13.876968 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.223335369718974e-18 } }