{ "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" [ [ 0.438828 2.90963 1.106787 ] [ 1.47463 4.835343 1.863436 ] [ 2.314132 3.251036 2.795551 ] [ 3.696872 4.248886 0.9164855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.38828e-11 2.90963e-10 1.106787e-10 ] [ 1.47463e-10 4.835343e-10 1.863436e-10 ] [ 2.314132e-10 3.251036e-10 2.795551e-10 ] [ 3.696872e-10 4.248886e-10 9.164855e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.1173479 -2.4576657 -2.0849458 ] [ -3.1876463 8.1551733 -2.2412036 ] [ 3.9010608 -6.1677694 5.8252255 ] [ 2.4039335 0.4702618 -1.4990762 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.994541924279977e-09 -3.937614526282066e-09 -3.340451416395152e-09 ] [ -5.107172377239624e-09 1.306602799983239e-08 -3.590804010372795e-09 ] [ 6.250188410079346e-09 -9.881855935165644e-09 9.333040106987992e-09 ] [ 3.851526051657917e-09 7.534424616153255e-10 -2.401784840437705e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.2266696 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.771871216966088e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4384954 3.1300748 1.7607182 ] [ 1.3314612 5.1850471 0.9341365 ] [ 2.6307698 2.4374003 2.4069932 ] [ 3.5237356 4.4923727 1.5804116 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.384954e-11 3.1300748e-10 1.7607182e-10 ] [ 1.3314612e-10 5.1850471e-10 9.341365e-11 ] [ 2.6307698e-10 2.4374003e-10 2.4069932e-10 ] [ 3.5237356e-10 4.4923727e-10 1.5804116e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2e-07 1e-07 -0.0 ] [ 0.0 -0.0 1e-07 ] [ -0.0 1e-07 -0.0 ] [ -2e-07 -1e-07 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.2043532416e-16 1.6021766208e-16 0.0 ] [ 0.0 0.0 1.6021766208e-16 ] [ 0.0 1.6021766208e-16 0.0 ] [ -3.2043532416e-16 -1.6021766208e-16 0.0 ] ] } "relaxed-potential-energy" { "source-value" -8.1407198 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.304287094004365e-18 } }