{ "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" [ [ -9.426318 -12.8895073 -5.9681857 ] [ -4.1479389 -13.6260763 23.166545 ] [ -16.6763536 10.0180676 -7.7370784 ] [ 9.9865071 -3.7269945 -19.4651128 ] [ 9.659115 -5.0522183 3.3148155 ] [ 8.2014807 8.2863453 -9.8987602 ] [ 2.4035076 16.9903835 16.5877768 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.510262631982621e-08 -2.065126724969093e-08 -9.562087597132882e-09 ] [ -6.645730730086868e-09 -2.183138088109697e-08 3.711689678371114e-08 ] [ -2.671846385811391e-08 1.605071369431397e-08 -1.239616612577667e-08 ] [ 1.600014819907321e-08 -5.971303453750186e-09 -3.118654864939483e-08 ] [ 1.547560823061859e-08 -8.09454604343792e-09 5.310919896365462e-09 ] [ 1.314022063348242e-08 1.327618871153596e-08 -1.585956216734553e-08 ] [ 3.850843684635118e-09 2.722159522212608e-08 2.657654818000864e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.40097697 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.42435926813223e-20 } "relaxed-configuration-positions" { "source-value" [ [ 1.9568921 1.6919158 2.6985463 ] [ 3.0660839 1.8625296 4.9625417 ] [ 1.7815998 4.2126429 2.7154362 ] [ 4.2507411 1.9669376 1.6749669 ] [ 5.2243593 1.7262632 3.8770479 ] [ 3.8025598 4.327611 1.3897243 ] [ 2.491264 4.2120419 5.0287436 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9568921e-10 1.6919158e-10 2.6985463e-10 ] [ 3.066083900000001e-10 1.8625296e-10 4.9625417e-10 ] [ 1.7815998e-10 4.2126429e-10 2.7154362e-10 ] [ 4.2507411e-10 1.9669376e-10 1.6749669e-10 ] [ 5.2243593e-10 1.7262632e-10 3.8770479e-10 ] [ 3.8025598e-10 4.327611e-10 1.3897243e-10 ] [ 2.491264e-10 4.2120419e-10 5.0287436e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.4e-06 -6.2e-06 3.3e-06 ] [ 1.12e-05 -3.05e-05 3.5e-06 ] [ -3.24e-05 2.93e-05 -7e-06 ] [ 2.6e-06 -2.54e-05 5.9e-06 ] [ 1.35e-05 -3.1e-06 5.7e-06 ] [ 1.2e-05 2.28e-05 -1.49e-05 ] [ -4.6e-06 1.31e-05 3.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.84522388992e-15 -9.93349504896e-15 5.28718284864e-15 ] [ 1.794437815296e-14 -4.88663869344e-14 5.6076181728e-15 ] [ -5.191052251392001e-14 4.694377498944e-14 -1.12152363456e-14 ] [ 4.16565921408e-15 -4.069528616832e-14 9.45284206272e-15 ] [ 2.16293843808e-14 -4.96674752448e-15 9.13240673856e-15 ] [ 1.92261194496e-14 3.652962695424e-14 -2.387243164992e-14 ] [ -7.370012455680001e-15 2.098851373248e-14 5.928053496960001e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.457688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.797029956682071e-18 } }