{ "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" [ [ 2.166449 2.681347 1.091002 ] [ 2.041583 4.789781 2.041915 ] [ 2.132392 3.124558 3.564623 ] [ 4.758388 2.994993 0.5845722 ] [ 4.303836 3.011562 3.07876 ] [ 3.921174 5.3024 1.134071 ] [ 3.577747 5.183138 3.725421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.166449e-10 2.681347e-10 1.091002e-10 ] [ 2.041583e-10 4.789780999999999e-10 2.041915e-10 ] [ 2.132392e-10 3.124558e-10 3.564623e-10 ] [ 4.758388e-10 2.994993e-10 5.845722e-11 ] [ 4.303836000000001e-10 3.011562e-10 3.07876e-10 ] [ 3.921174e-10 5.3024e-10 1.134071e-10 ] [ 3.577747e-10 5.183138e-10 3.725421e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0165631 -2.966152 -2.8719626 ] [ -7.9094803 5.0347646 -3.0592961 ] [ -4.4302728 -4.6618862 4.6744341 ] [ -0.7032555 0.1716645 0.3324768 ] [ 5.916099 -3.492903 0.2228682 ] [ 4.2673398 1.795896 -3.3611465 ] [ 2.8761329 4.1186161 4.0626262 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.653701158797248e-11 -4.752299388139162e-09 -4.601391333531981e-09 ] [ -1.267238441933817e-08 8.066582133351464e-09 -4.901532687524619e-09 ] [ -7.098079503926155e-09 -7.469165078470153e-09 7.489269030490289e-09 ] [ -1.126739520549015e-09 2.750368485213216e-10 5.326865559183974e-10 ] [ 9.47863550413826e-09 -5.596247525322183e-09 3.570742195597785e-10 ] [ 6.837032060569349e-09 2.877342584588237e-09 -5.385150341383747e-09 ] [ 4.608072890693704e-09 6.598750425470475e-09 6.509044716689545e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.042454 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.570284473905945e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1092049 2.6567672 1.0359608 ] [ 1.6971679 4.9878321 1.8407609 ] [ 2.1731263 2.9583176 3.5171635 ] [ 4.4987416 3.0550751 0.839753 ] [ 4.6577564 2.857189 3.2569 ] [ 4.055232 5.4264383 1.1346856 ] [ 3.7103399 5.1461597 3.5951404 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1092049e-10 2.6567672e-10 1.0359608e-10 ] [ 1.6971679e-10 4.9878321e-10 1.8407609e-10 ] [ 2.1731263e-10 2.9583176e-10 3.5171635e-10 ] [ 4.4987416e-10 3.0550751e-10 8.39753e-11 ] [ 4.6577564e-10 2.857189e-10 3.2569e-10 ] [ 4.055232e-10 5.4264383e-10 1.1346856e-10 ] [ 3.710339900000001e-10 5.146159700000001e-10 3.5951404e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.3e-06 7.4e-06 3.11e-05 ] [ 4.28e-05 -1.11e-05 3.8e-06 ] [ 1.08e-05 1.18e-05 -4.21e-05 ] [ -1.55e-05 2.82e-05 3.35e-05 ] [ -2.6e-05 3.71e-05 -2.34e-05 ] [ -2.37e-05 -3.72e-05 1.09e-05 ] [ 4.4e-06 -3.62e-05 -1.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.169588933184e-14 1.185610699392e-14 4.982769290688e-14 ] [ 6.857315937023999e-14 -1.778416049088e-14 6.08827115904e-15 ] [ 1.730350750464e-14 1.890568412544e-14 -6.745163573568001e-14 ] [ -2.48337376224e-14 4.518138070656001e-14 5.36729167968e-14 ] [ -4.16565921408e-14 5.944075263168e-14 -3.749093292672001e-14 ] [ -3.797158591296e-14 -5.960097029376001e-14 1.746372516672e-14 ] [ 7.04957713152e-15 -5.799879367296e-14 -2.194981970496e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }