{ "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" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3872208 -0.4416452 -0.9208229 ] [ 1.4671985 -0.9790413 0.0109551 ] [ 1.7977576 1.1792207 -1.4084677 ] [ 1.3884148 3.8547966 4.7842605 ] [ -3.7416415 -2.455479 -0.2403574 ] [ -2.330382 -0.0044055 1.446278 ] [ 1.0314318 -1.1534464 -3.6718456 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.203961128474726e-10 -7.075936141285402e-10 -1.475320922277256e-09 ] [ 2.350711134772829e-09 -1.568597081657639e-09 1.755200509852608e-11 ] [ 2.880325196585518e-09 1.88931983630341e-09 -2.256614020091948e-09 ] [ 2.224485732532708e-09 6.176064990459329e-09 7.66523032091692e-09 ] [ -5.994770534715044e-09 -3.934111046665363e-09 -3.850950069162739e-10 ] [ -3.733683557933146e-09 -7.0583891029344e-12 2.317192798777382e-09 ] [ 1.652535915909662e-09 -1.848024855425925e-09 -5.882945175507349e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.58959 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.420339607545748e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9342481 2.1695965 4.5783745 ] [ 2.4765828 3.7393273 2.9971388 ] [ 5.1456344 1.4113978 3.2639444 ] [ 4.6881307 3.4921898 2.3565437 ] [ 3.131421 1.7115679 1.9450044 ] [ 3.195504 0.3755371 3.8823812 ] [ 4.1172069 3.0486105 4.6457911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9342481e-10 2.1695965e-10 4.5783745e-10 ] [ 2.4765828e-10 3.7393273e-10 2.9971388e-10 ] [ 5.1456344e-10 1.4113978e-10 3.2639444e-10 ] [ 4.688130700000001e-10 3.4921898e-10 2.3565437e-10 ] [ 3.131421e-10 1.7115679e-10 1.9450044e-10 ] [ 3.195504e-10 3.755371e-11 3.8823812e-10 ] [ 4.1172069e-10 3.0486105e-10 4.6457911e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.04e-05 -3.54e-05 2.9e-06 ] [ 1.03e-05 -1.6e-06 -2.4e-06 ] [ 3.91e-05 3.82e-05 3.78e-05 ] [ 1.74e-05 2.72e-05 3.81e-05 ] [ -5.12e-05 -1.87e-05 -3.11e-05 ] [ -4.78e-05 3.55e-05 2.96e-05 ] [ 1.8e-06 -4.53e-05 -7.48e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.870616927232e-14 -5.671705237632e-14 4.646312200320001e-15 ] [ 1.650241919424e-14 -2.56348259328e-15 -3.84522388992e-15 ] [ 6.264510587328001e-14 6.120314691456e-14 6.056227626623999e-14 ] [ 2.787787320192e-14 4.357920408576e-14 6.104292925248e-14 ] [ -8.203144298496001e-14 -2.996070280896e-14 -4.982769290688e-14 ] [ -7.658404247424001e-14 5.68772700384e-14 4.742442797568e-14 ] [ 2.88391791744e-15 -7.257860092224001e-14 -1.1984281123584e-13 ] ] } "relaxed-potential-energy" { "source-value" -30.333444 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.859953480514604e-18 } }