{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2519361 0.630526 0.2961672 ] [ 1.040527 1.338339 0.9480581 ] [ 1.471162 2.964903 0.310665 ] [ 0.0960364 2.590998 1.829013 ] [ 2.039261 0.0625187 0.2196196 ] [ 2.19391 1.549757 2.906446 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.519361e-11 6.30526e-11 2.961672e-11 ] [ 1.040527e-10 1.338339e-10 9.480581e-11 ] [ 1.471162e-10 2.964903e-10 3.10665e-11 ] [ 9.60364e-12 2.590998e-10 1.829013e-10 ] [ 2.039261e-10 6.25187e-12 2.196196e-11 ] [ 2.19391e-10 1.549757e-10 2.906446e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19687.113234 -17554.1887173 -16192.9390134 ] [ 19523.0430498 17452.3554834 16270.2227538 ] [ 52.697284 167.3995786 -74.7674961 ] [ -103.9919593 124.3798934 100.5277644 ] [ 220.2983818 -190.976523 -96.3676714 ] [ -4.9335222 1.0302849 -6.6763373 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.154223255455708e-05 -2.81249107599692e-05 -2.59439483093097e-05 ] [ 3.127936314126149e-05 2.796175593339416e-05 2.606777051134656e-05 ] [ 8.443035640445792e-08 2.68203691164692e-07 -1.197907342471752e-07 ] [ -1.666134859416451e-07 1.992785573030762e-07 1.610632338629705e-07 ] [ 3.529569169200322e-07 -3.059781202722734e-07 -1.543980301180168e-07 ] [ -7.90437392703778e-09 1.650698379543266e-09 -1.0696671534635e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 3149.9981 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.04685331138442e-16 } "relaxed-configuration-positions" { "source-value" [ [ -0.0567379 0.9743699 0.1480076 ] [ 1.4410706 0.585054 1.7339283 ] [ 1.6010033 2.4128787 0.4525494 ] [ -0.0115404 2.2426726 1.9628063 ] [ 2.0222524 0.4152936 -0.3900134 ] [ 2.0967845 2.5067728 2.6026907 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.67379e-12 9.743699000000001e-11 1.480076e-11 ] [ 1.4410706e-10 5.85054e-11 1.7339283e-10 ] [ 1.6010033e-10 2.4128787e-10 4.525494e-11 ] [ -1.15404e-12 2.2426726e-10 1.9628063e-10 ] [ 2.0222524e-10 4.152936e-11 -3.900134000000001e-11 ] [ 2.0967845e-10 2.5067728e-10 2.6026907e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.68e-05 0.0001405 4.11e-05 ] [ 3.37e-05 0.0002231 -9.75e-05 ] [ 1.55e-05 -0.0001649 0.0001757 ] [ 0.0001198 -0.0001783 -5.3e-05 ] [ -0.0001115 -0.0001162 -7.44e-05 ] [ -0.0001344 9.58e-05 8.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.2304716447744e-13 2.251058152224e-13 6.584945911488e-14 ] [ 5.399335212096e-14 3.5744560410048e-13 -1.56212220528e-13 ] [ 2.48337376224e-14 -2.6419892476992e-13 2.8150243227456e-13 ] [ 1.9194075917184e-13 -2.8566809148864e-13 -8.49153609024e-14 ] [ -1.786426932192e-13 -1.8617292333696e-13 -1.1920194058752e-13 ] [ -2.1533253783552e-13 1.5348852027264e-13 1.297763062848e-14 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }