{ "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" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4249688 -1.0311951 -2.6793348 ] [ -0.6304114 -0.3871772 0.3714033 ] [ -1.7361575 0.0729911 -0.0416865 ] [ -0.044946 -0.6611679 -2.0892865 ] [ 1.0561172 1.4228899 2.1070632 ] [ -0.2341381 -1.0949044 0.9696915 ] [ 3.0145046 1.6785637 1.3621498 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.283051696729431e-09 -1.652156680703518e-09 -4.292767575855844e-09 ] [ -1.010030406565797e-09 -6.203262579468058e-10 5.950536841479686e-10 ] [ -2.781630956526576e-09 1.169446339464749e-10 -6.67891357029792e-11 ] [ -7.201143039847679e-11 -1.059307751803432e-09 -3.347405984453059e-09 ] [ 1.692086286664758e-09 2.27972093175245e-09 3.375887397588034e-09 ] [ -3.751305898585324e-10 -1.754230231691052e-09 1.553617050688483e-09 ] [ 4.829768793414055e-09 2.689355516663545e-09 2.182404563587396e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.584286 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.739925137226075e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0142705 2.0212173 1.9804292 ] [ 2.7119382 1.7599964 4.3353604 ] [ 1.571893 3.7681793 3.4588909 ] [ 4.3025661 1.7475113 2.1395209 ] [ 4.9734709 2.3132681 4.3582896 ] [ 3.3435699 4.08814 1.7734132 ] [ 3.6557913 4.3016296 4.3011028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0142705e-10 2.0212173e-10 1.9804292e-10 ] [ 2.7119382e-10 1.7599964e-10 4.3353604e-10 ] [ 1.571893e-10 3.7681793e-10 3.4588909e-10 ] [ 4.3025661e-10 1.7475113e-10 2.1395209e-10 ] [ 4.9734709e-10 2.3132681e-10 4.3582896e-10 ] [ 3.3435699e-10 4.08814e-10 1.7734132e-10 ] [ 3.6557913e-10 4.3016296e-10 4.3011028e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-06 1.36e-05 4.6e-06 ] [ 2.1e-06 2.2e-05 -1.48e-05 ] [ 1.54e-05 -2.85e-05 -5.8e-06 ] [ -8.1e-06 -8e-07 1.31e-05 ] [ 8e-06 -1.16e-05 1.64e-05 ] [ -1.71e-05 1.15e-05 -6.3e-06 ] [ 6e-07 -6e-06 -7.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-15 2.178960204288e-14 7.370012455680001e-15 ] [ 3.36457090368e-15 3.52478856576e-14 -2.371221398784e-14 ] [ 2.467351996032e-14 -4.56620336928e-14 -9.292624400640001e-15 ] [ -1.297763062848e-14 -1.28174129664e-15 2.098851373248e-14 ] [ 1.28174129664e-14 -1.858524880128e-14 2.627569658112e-14 ] [ -2.739722021568e-14 1.84250311392e-14 -1.009371271104e-14 ] [ 9.6130597248e-16 -9.6130597248e-15 -1.153567166976e-14 ] ] } "relaxed-potential-energy" { "source-value" -32.196266 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.158410466225794e-18 } }