{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.05932 0 0 ] "si-unit" "m" "si-value" [ 5.059319999999999e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.224512 5.44129 0 ] "si-unit" "m" "si-value" [ 2.24512e-11 5.441290000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.327401 0.688972 5.24092 ] "si-unit" "m" "si-value" [ 3.27401e-11 6.88972e-11 5.24092e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.119472 0.0796179 0.152764 ] [ 1.48092 1.5486 0.772169 ] [ 0.0612704 2.84226 2.7863 ] [ 1.84412 4.4971 3.9905 ] [ 2.88701 0.305191 2.51679 ] [ 4.25223 1.88781 3.92663 ] [ 2.58737 2.78734 -0.624797 ] [ 3.988 4.24006 0.48768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.19472e-11 7.96179e-12 1.52764e-11 ] [ 1.48092e-10 1.5486e-10 7.72169e-11 ] [ 6.127040000000001e-12 2.84226e-10 2.786300000000001e-10 ] [ 1.84412e-10 4.4971e-10 3.9905e-10 ] [ 2.88701e-10 3.05191e-11 2.51679e-10 ] [ 4.25223e-10 1.88781e-10 3.92663e-10 ] [ 2.58737e-10 2.78734e-10 -6.247970000000001e-11 ] [ 3.988e-10 4.24006e-10 4.8768e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 12.4010692 7.0962128 -3.9865437 ] [ -1.5795164 -2.2362718 8.7425828 ] [ 13.6460997 11.2210068 -16.1385001 ] [ -22.5040904 17.6520575 -14.8268555 ] [ 0.8408451 2.6158623 -3.2614668 ] [ -10.6623639 -8.772911 3.6754484 ] [ 15.5590732 -14.9104587 13.6756818 ] [ -7.7011165 -12.6654979 12.1196531 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.986870314516296e-08 1.136938624438171e-08 -6.387147113937529e-09 ] [ -2.530664248250181e-09 -3.582902395714333e-09 1.40071617675682e-08 ] [ 2.186346190444589e-08 1.797803475679782e-08 -2.585672755499847e-08 ] [ -3.605552751124972e-08 2.82817138355173e-08 -2.37552412420799e-08 ] [ 1.347182360934238e-09 4.191073420292116e-09 -5.22544585647539e-09 ] [ -1.708299016304191e-08 -1.405575290055915e-08 5.888717497436767e-09 ] [ 2.492838332235584e-08 -2.388918833454396e-08 2.191085765346006e-08 ] [ -1.233854881035712e-08 -2.02923646261715e-08 1.941782484902625e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -12.238105 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.960760571389558e-18 } }