{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.989907 0.3585894 1.995615 ] [ 2.640493 2.59546 1.392112 ] [ 2.7347 2.276458 3.733048 ] [ 4.272646 1.115879 1.870464 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.989907e-10 3.585894e-11 1.995615e-10 ] [ 2.640493e-10 2.59546e-10 1.392112e-10 ] [ 2.7347e-10 2.276458e-10 3.733048e-10 ] [ 4.272646e-10 1.115879e-10 1.870464e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.25584 -3.2553572 -0.8417877 ] [ -0.7149752 2.5501846 -2.0117417 ] [ -0.5769961 2.1379349 4.0443984 ] [ 3.5478113 -1.4327623 -1.190869 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.614254108265472e-09 -5.21565719819295e-09 -1.348692572617004e-09 ] [ -1.145516549891804e-09 4.085846144844201e-09 -3.223165518828447e-09 ] [ -9.244496617127789e-10 3.425349313572386e-09 6.479840561680928e-09 ] [ 5.684220319870055e-09 -2.295538260223636e-09 -1.907982470235475e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.8840759 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.102950546279272e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5034316 0.0144761 2.7823856 ] [ 3.3154412 3.1587174 1.7132346 ] [ 1.8591695 2.2559822 3.4187217 ] [ 3.9597037 0.9172107 1.0768971 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5034316e-10 1.44761e-12 2.7823856e-10 ] [ 3.3154412e-10 3.1587174e-10 1.7132346e-10 ] [ 1.8591695e-10 2.2559822e-10 3.4187217e-10 ] [ 3.9597037e-10 9.172107e-11 1.0768971e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.5e-06 -3e-07 -4.3e-06 ] [ 5.5e-06 -6e-06 -6.3e-06 ] [ -4.1e-06 3e-07 5e-06 ] [ -4.9e-06 6e-06 5.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.6076181728e-15 -4.8065298624e-16 -6.889359469440001e-15 ] [ 8.8119714144e-15 -9.6130597248e-15 -1.009371271104e-14 ] [ -6.568924145279999e-15 4.8065298624e-16 8.010883104e-15 ] [ -7.850665441919999e-15 9.6130597248e-15 8.972189076479999e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.363135 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.660357261519421e-18 } }