{ "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" [ [ -3.8251341 -2.2469302 2.7539032 ] [ -0.1423522 1.200328 -1.7837218 ] [ 4.6700887 -0.4108621 -1.8609875 ] [ 7.5944823 6.3991024 1.3864836 ] [ -6.8160049 -2.7131815 -3.5007152 ] [ -2.5091123 -2.7535457 3.356 ] [ 1.0280325 0.5250891 -0.3509622 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.128540476936619e-09 -3.599979064668946e-09 4.412239359337828e-09 ] [ -2.280733686384948e-10 1.923137474735952e-09 -2.857837389516421e-09 ] [ 7.482306993847435e-09 -6.582736564161714e-10 -2.981630688666075e-09 ] [ 1.216770208838658e-08 1.025249234385332e-08 2.221391627344202e-09 ] [ -1.092044378800951e-08 -4.346996003101071e-09 -5.608764095728637e-09 ] [ -4.020041099141997e-09 -4.411666581191174e-09 5.376904783704e-09 ] [ 1.647089650492605e-09 8.412854867880893e-10 -5.623034362572347e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.889696 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.866245292056326e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0585965 2.0612523 4.471071 ] [ 2.4241503 3.9431821 2.8796674 ] [ 5.2474634 0.9960052 2.7245223 ] [ 4.8449058 3.3773366 2.7135469 ] [ 2.9779641 1.6919348 2.071912 ] [ 3.3609395 0.1049243 3.9146431 ] [ 3.7747084 3.7735916 4.8938153 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0585965e-10 2.0612523e-10 4.471071e-10 ] [ 2.4241503e-10 3.9431821e-10 2.8796674e-10 ] [ 5.2474634e-10 9.960052000000001e-11 2.7245223e-10 ] [ 4.8449058e-10 3.3773366e-10 2.7135469e-10 ] [ 2.9779641e-10 1.6919348e-10 2.071912e-10 ] [ 3.3609395e-10 1.049243e-11 3.9146431e-10 ] [ 3.7747084e-10 3.7735916e-10 4.8938153e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0001032 2.06e-05 -0.0001093 ] [ 2.05e-05 2.7e-05 6.78e-05 ] [ -8e-05 4.28e-05 0.0001145 ] [ -0.0001489 -4.79e-05 -3.59e-05 ] [ 6.96e-05 -7.14e-05 5.21e-05 ] [ -7e-06 1.96e-05 -9.38e-05 ] [ 4.26e-05 9.2e-06 4.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.653446286288e-13 3.300483866039999e-14 -1.751179060962e-13 ] [ 3.2844620997e-14 4.325876911799999e-14 1.086275757852e-13 ] [ -1.2817413072e-13 6.857315993519999e-14 1.83449224593e-13 ] [ -2.385641008025999e-13 -7.674426076859999e-14 -5.751814116059999e-14 ] [ 1.115114937264e-13 -1.143954116676e-13 8.347340263139999e-14 ] [ -1.1215236438e-14 3.140266202639999e-14 -1.502841682692e-13 ] [ 6.82527246084e-14 1.47400250328e-14 7.370012516399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.254434 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.565553415769516e-18 } }