{ "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" [ [ -3.224668200281095e-09 -7.527040985196298e-09 -1.253898495084309e-08 ] [ 1.390942450760486e-10 -3.182997829421357e-10 -2.30902378084091e-09 ] [ -1.015163924654736e-08 -7.545582013922844e-09 4.031468911204896e-09 ] [ -6.958163342243635e-09 4.977151739020151e-09 1.333088493854047e-09 ] [ 1.247199073653265e-08 -5.345301004471209e-09 4.681221225622301e-09 ] [ 4.703460077989654e-09 6.908845622155156e-09 -2.486547513908143e-09 ] [ 3.019925569256077e-09 8.850226425357181e-09 7.288777614910902e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.813555 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.854046135433495e-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" [ [ 5.28718284864e-15 -1.714328984256e-14 -8.491536090240001e-15 ] [ -4.48609453824e-15 -1.04141480352e-14 -5.928053496960001e-15 ] [ -7.53023011776e-15 -3.108222644352e-14 6.4087064832e-15 ] [ 9.6130597248e-16 2.08282960704e-14 1.217654231808e-14 ] [ -1.329806595264e-14 -4.96674752448e-15 -1.12152363456e-15 ] [ 1.089480102144e-14 1.730350750464e-14 4.8065298624e-16 ] [ 8.010883104e-15 2.56348259328e-14 -3.52478856576e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.258503 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.566205312060666e-18 } }