{ "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" [ [ 2.851893 1.689536 1.360291 ] [ 1.367517 2.93292 5.4803 ] [ 1.756353 1.339195 3.328571 ] [ 1.204701 3.536746 3.011508 ] [ 3.888723 1.68848 3.240915 ] [ 3.83892 3.544284 1.733331 ] [ 3.269318 3.65155 3.991072 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.851893e-10 1.689536e-10 1.360291e-10 ] [ 1.367517e-10 2.93292e-10 5.4803e-10 ] [ 1.756353e-10 1.339195e-10 3.328571e-10 ] [ 1.204701e-10 3.536746e-10 3.011508e-10 ] [ 3.888723e-10 1.68848e-10 3.240915e-10 ] [ 3.83892e-10 3.544284e-10 1.733331e-10 ] [ 3.269318e-10 3.65155e-10 3.991072e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0126796 -4.6980095 -7.8262189 ] [ 0.0868158 -0.1986671 -1.4411793 ] [ -6.3361549 -4.7095819 2.516245 ] [ -4.342944 3.1064938 0.8320484 ] [ 7.7844044 -3.3362745 2.9217885 ] [ 2.9356689 4.3121623 -1.5519809 ] [ 1.8848893 5.5238769 4.5492972 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.224668226848466e-09 -7.527041047210023e-09 -1.253898505414918e-08 ] [ 1.390942462220172e-10 -3.182997855645414e-10 -2.309023799864476e-09 ] [ -1.015163933018461e-08 -7.545582076089323e-09 4.03146894441933e-09 ] [ -6.958163399570495e-09 4.977151780025869e-09 1.333088504837086e-09 ] [ 1.247199083928679e-08 -5.345301048510033e-09 4.681221264189908e-09 ] [ 4.703460116740482e-09 6.908845679075697e-09 -2.48654753439429e-09 ] [ 3.019925594136616e-09 8.850226498272353e-09 7.288777674961624e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.813555 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.854046158947387e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9611839 1.419432 1.3014128 ] [ 2.0194815 2.4830235 5.1400668 ] [ 1.2913453 1.3670803 3.0431216 ] [ 0.7586039 3.7245357 3.461342 ] [ 3.7910334 1.7498177 3.597765 ] [ 4.2230533 3.3925174 1.8128478 ] [ 3.1327238 4.2463044 3.7894321 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9611839e-10 1.419432e-10 1.3014128e-10 ] [ 2.0194815e-10 2.4830235e-10 5.1400668e-10 ] [ 1.2913453e-10 1.3670803e-10 3.0431216e-10 ] [ 7.586039e-11 3.7245357e-10 3.461342e-10 ] [ 3.7910334e-10 1.7498177e-10 3.597765e-10 ] [ 4.2230533e-10 3.3925174e-10 1.8128478e-10 ] [ 3.1327238e-10 4.2463044e-10 3.7894321e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.3e-06 -1.07e-05 -5.3e-06 ] [ -2.8e-06 -6.5e-06 -3.7e-06 ] [ -4.7e-06 -1.94e-05 4e-06 ] [ 6e-07 1.3e-05 7.6e-06 ] [ -8.3e-06 -3.1e-06 -7e-07 ] [ 6.8e-06 1.08e-05 3e-07 ] [ 5e-06 1.6e-05 -2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.2871828922e-15 -1.71432899838e-14 -8.4915361602e-15 ] [ -4.486094575199999e-15 -1.0414148121e-14 -5.9280535458e-15 ] [ -7.530230179799999e-15 -3.10822266996e-14 6.408706535999999e-15 ] [ 9.613059803999998e-16 2.082829624199999e-14 1.21765424184e-14 ] [ -1.32980660622e-14 -4.9667475654e-15 -1.1215236438e-15 ] [ 1.08948011112e-14 1.73035076472e-14 4.806529901999999e-16 ] [ 8.010883169999999e-15 2.5634826144e-14 -3.5247885948e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.258503 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.56620534144189e-18 } }