{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.3890178 0.3060136 0.2686133 ] [ 1.00003 0.111897 2.250713 ] [ 0.4846776 2.300953 2.298336 ] [ 2.957925 0.3909324 0.2522672 ] [ 2.37443 2.221414 1.416157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.890178e-11 3.060136e-11 2.686133e-11 ] [ 1.00003e-10 1.11897e-11 2.250713e-10 ] [ 4.846776e-11 2.300953e-10 2.298336e-10 ] [ 2.957925e-10 3.909324e-11 2.522672e-11 ] [ 2.37443e-10 2.221414e-10 1.416157e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9008177 1.7128414 -2.0421012 ] [ 1.3898577 -4.8784043 2.2257702 ] [ -3.4570707 2.7515634 1.5494144 ] [ -1.2075515 -1.4161823 0.7105182 ] [ 2.3739468 1.8301818 -2.4436017 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.443269070433622e-09 2.744274468827847e-09 -3.27180682690336e-09 ] [ 2.226797531524982e-09 -7.816065380665124e-09 3.566077007093506e-09 ] [ -5.538837897626024e-09 4.408490586449595e-09 2.482435548063129e-09 ] [ -1.934710797651651e-09 -2.268974190544378e-09 1.138375658071739e-09 ] [ 3.803482093319071e-09 2.932274515932061e-09 -3.915081546542677e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.381934 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.983804533853015e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5504737 -0.5541583 -0.1659679 ] [ 0.7883564 0.3769596 2.0504937 ] [ 0.5651151 2.6651311 2.7925624 ] [ 2.6471015 0.5430973 0.0972223 ] [ 2.6550338 2.3001802 1.7117759 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.504737e-11 -5.541583e-11 -1.659679e-11 ] [ 7.883564e-11 3.769596e-11 2.0504937e-10 ] [ 5.651151e-11 2.6651311e-10 2.7925624e-10 ] [ 2.647101500000001e-10 5.430973e-11 9.72223e-12 ] [ 2.6550338e-10 2.3001802e-10 1.7117759e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.03e-05 -0.0002105 -0.0001788 ] [ -8.36e-05 1.71e-05 0.0001321 ] [ 1.11e-05 0.0001541 0.000118 ] [ 0.000109 0.0001248 -3.81e-05 ] [ 3.8e-06 -8.54e-05 -3.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.456771835019998e-14 -3.372581814569999e-13 -2.864691821592e-13 ] [ -1.339419666024e-13 2.73972204414e-14 2.116475333514e-13 ] [ 1.77841606374e-14 2.468954192994e-13 1.89056842812e-13 ] [ 1.74637253106e-13 1.999516439232e-13 -6.10429297554e-14 ] [ 6.088271209199999e-15 -1.368258845436e-13 -5.31922642488e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.0364 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.40909687394776e-18 } }