{ "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" [ [ 2.221555 1.50122 1.826509 ] [ 1.576881 2.934657 3.026633 ] [ 2.584327 1.716088 4.47164 ] [ 2.903501 3.607036 1.073051 ] [ 4.2877 3.061946 5.191695 ] [ 4.423391 1.863673 3.155042 ] [ 3.612063 4.220863 3.087476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.221555e-10 1.50122e-10 1.826509e-10 ] [ 1.576881e-10 2.934657e-10 3.026633e-10 ] [ 2.584327e-10 1.716088e-10 4.47164e-10 ] [ 2.903501e-10 3.607036e-10 1.073051e-10 ] [ 4.2877e-10 3.061946e-10 5.191695e-10 ] [ 4.423391e-10 1.863673e-10 3.155042e-10 ] [ 3.612063e-10 4.220863e-10 3.087476e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9392062 -11.5111727 -10.7781115 ] [ -16.5482362 8.1774386 5.8218006 ] [ -5.40002 -9.0488302 12.1769534 ] [ 1.5263758 4.2138026 -9.9802455 ] [ 3.0400984 3.0637061 6.3345667 ] [ 13.3262385 -7.7106556 -3.7421617 ] [ 4.9947496 12.8157112 0.1671979 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.504774215750409e-09 -1.844293177793121e-08 -1.726843826167562e-08 ] [ -2.651319715511623e-08 1.310170094294748e-08 9.327552812279414e-09 ] [ -8.651785795852415e-09 -1.449782419202899e-08 1.950963005005107e-08 ] [ 2.445523621314897e-09 6.751256010386254e-09 -1.599011600994441e-08 ] [ 4.870774581411487e-09 4.908598286422347e-09 1.014909466963821e-08 ] [ 2.135098776790486e-08 -1.23538321333606e-08 -5.995603986993184e-09 ] [ 8.00247103587015e-09 2.053303286356471e-08 2.678805664268564e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.7249781 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.172426066412005e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5929888 1.7296849 1.5579472 ] [ 1.3357479 2.8113892 3.3559691 ] [ 2.5276518 1.6478393 5.0886034 ] [ 3.4573844 3.885168 0.9668021 ] [ 4.5057946 3.2277909 4.466748 ] [ 4.1922542 1.0034225 3.1886199 ] [ 2.9975963 4.6001882 3.2073563 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5929888e-10 1.7296849e-10 1.5579472e-10 ] [ 1.3357479e-10 2.8113892e-10 3.3559691e-10 ] [ 2.5276518e-10 1.6478393e-10 5.0886034e-10 ] [ 3.4573844e-10 3.885168e-10 9.668021e-11 ] [ 4.5057946e-10 3.2277909e-10 4.466748e-10 ] [ 4.1922542e-10 1.0034225e-10 3.1886199e-10 ] [ 2.9975963e-10 4.6001882e-10 3.2073563e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.7e-06 3.18e-05 6e-06 ] [ -9.6e-06 1.6e-05 5.4e-06 ] [ 4e-06 -2.37e-05 -7.8e-06 ] [ 4.5e-06 -5.9e-06 1.38e-05 ] [ 1.19e-05 1.96e-05 1.34e-05 ] [ 6.8e-06 -7.9e-06 6.8e-06 ] [ -7.9e-06 -3e-05 -3.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.554111322176e-14 5.094921654144e-14 9.6130597248e-15 ] [ -1.538089555968e-14 2.56348259328e-14 8.65175375232e-15 ] [ 6.4087064832e-15 -3.797158591296e-14 -1.249697764224e-14 ] [ 7.2097947936e-15 -9.45284206272e-15 2.211003736704e-14 ] [ 1.906590178752e-14 3.140266176767999e-14 2.146916671872e-14 ] [ 1.089480102144e-14 -1.265719530432e-14 1.089480102144e-14 ] [ -1.265719530432e-14 -4.8065298624e-14 -6.024184094208e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }