{ "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" [ [ 2.384535 1.809355 2.901981 ] [ 1.948299 3.967012 2.633856 ] [ 1.645033 3.274995 4.707865 ] [ 4.440095 1.758867 2.666287 ] [ 3.649735 2.240012 5.07701 ] [ 4.164388 4.024114 1.736165 ] [ 3.303688 4.596831 4.046686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.384535e-10 1.809355e-10 2.901981e-10 ] [ 1.948299e-10 3.967012e-10 2.633856000000001e-10 ] [ 1.645033e-10 3.274995e-10 4.707865e-10 ] [ 4.440095e-10 1.758867e-10 2.666287e-10 ] [ 3.649735e-10 2.240012e-10 5.07701e-10 ] [ 4.164388e-10 4.024114e-10 1.736165e-10 ] [ 3.303688e-10 4.596831e-10 4.046686e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.4919248 -7.3832578 -2.4077145 ] [ -6.9589001 3.7670407 -9.6752244 ] [ -7.2454176 -1.1997468 7.5873477 ] [ 5.7851898 0.2861287 -0.3623799 ] [ 3.5223359 -1.960857 1.9290658 ] [ 2.2395259 -0.0588908 -1.3954119 ] [ 8.1491908 6.5495831 4.3243171 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.799033517751715e-09 -1.182928303249924e-08 -3.857583881461161e-09 ] [ -1.114938704670278e-08 6.035464539142067e-09 -1.550141833467371e-08 ] [ -1.160843868665284e-08 -1.922206273839613e-09 1.215627109882065e-08 ] [ 9.268895844450628e-09 4.58428713679897e-10 -5.805966036278419e-10 ] [ 5.643404229584527e-09 -3.141639242132026e-09 3.090704124744849e-09 ] [ 3.588116038656078e-09 -9.435346294020865e-11 -2.235696322566108e-09 ] [ 1.305644297819845e-08 1.049358891880679e-08 6.928319758545656e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.033083 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.889218398354593e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3916932 1.8710988 2.7810258 ] [ 1.5920481 4.36991 2.5110509 ] [ 1.4590107 3.2992283 4.7927236 ] [ 4.9936919 2.1828169 3.0790186 ] [ 3.5613418 1.9475324 5.143748 ] [ 3.7766012 3.6799323 1.4519238 ] [ 3.7613862 4.3206673 4.0103593 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3916932e-10 1.8710988e-10 2.7810258e-10 ] [ 1.5920481e-10 4.36991e-10 2.5110509e-10 ] [ 1.4590107e-10 3.2992283e-10 4.7927236e-10 ] [ 4.9936919e-10 2.1828169e-10 3.0790186e-10 ] [ 3.5613418e-10 1.9475324e-10 5.143748e-10 ] [ 3.7766012e-10 3.6799323e-10 1.4519238e-10 ] [ 3.7613862e-10 4.320667300000001e-10 4.0103593e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.2e-06 2.69e-05 2.3e-05 ] [ -1.6e-06 1.5e-06 -2.8e-06 ] [ -7.6e-06 -7.9e-06 6.4e-06 ] [ 1.5e-06 5.7e-06 -5.2e-06 ] [ -2e-06 -1.39e-05 8.2e-06 ] [ 1.36e-05 1e-07 -1.35e-05 ] [ -9e-06 -1.24e-05 -1.61e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.33131842816e-15 4.309855109952001e-14 3.68500622784e-14 ] [ -2.56348259328e-15 2.4032649312e-15 -4.48609453824e-15 ] [ -1.217654231808e-14 -1.265719530432e-14 1.025393037312e-14 ] [ 2.4032649312e-15 9.13240673856e-15 -8.33131842816e-15 ] [ -3.2043532416e-15 -2.227025502912e-14 1.313784829056e-14 ] [ 2.178960204288e-14 1.6021766208e-16 -2.16293843808e-14 ] [ -1.44195895872e-14 -1.986699009792e-14 -2.579504359488e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.454184 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.917992188554143e-18 } }