{ "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" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.9164002 -10.9364961 -6.8270336 ] [ -6.4150199 -6.7131246 10.6278887 ] [ 6.6997626 11.9913254 -3.1193095 ] [ 1.2151072 6.1506279 4.7296591 ] [ 7.3011157 -6.0768105 -14.4884028 ] [ 7.741261 6.8750876 10.1350724 ] [ -2.6258264 -1.2906096 -1.0578744 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.229653104613645e-08 -1.752219836489038e-08 -1.093811362333606e-08 ] [ -1.027799490574675e-08 -1.075561128663735e-08 1.702775480360451e-08 ] [ 1.073420300263022e-08 1.921222120828521e-08 -4.997684753939338e-09 ] [ 1.94681634760575e-09 9.8543922246202e-09 7.57774923437397e-09 ] [ 1.169767688029583e-08 -9.736123712131957e-09 -2.321298023889326e-08 ] [ 1.240286738971083e-08 1.101510461867198e-08 1.623817604939535e-08 ] [ -4.207037668359429e-09 -2.06778452770004e-09 -1.694901631422828e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.81514 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.533864756267891e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3763552 2.3012341 2.3755838 ] [ 2.1793217 1.2294038 4.7320677 ] [ 2.5355742 4.6209453 2.0938461 ] [ 1.9909572 3.9270784 4.5486694 ] [ 3.7602824 1.1926171 2.5307648 ] [ 4.3749 2.8184892 4.70383 ] [ 4.8176774 3.5596681 2.2423593 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3763552e-10 2.3012341e-10 2.3755838e-10 ] [ 2.1793217e-10 1.2294038e-10 4.7320677e-10 ] [ 2.5355742e-10 4.6209453e-10 2.0938461e-10 ] [ 1.9909572e-10 3.9270784e-10 4.5486694e-10 ] [ 3.7602824e-10 1.1926171e-10 2.5307648e-10 ] [ 4.374900000000001e-10 2.8184892e-10 4.70383e-10 ] [ 4.8176774e-10 3.5596681e-10 2.2423593e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.2e-06 8e-06 3.2e-06 ] [ -2.28e-05 4.7e-06 6.2e-06 ] [ -3.26e-05 -2.15e-05 3.4e-06 ] [ 3.01e-05 7e-07 -1.83e-05 ] [ 9e-07 -5.2e-06 -1.94e-05 ] [ 1.15e-05 1e-05 -2.22e-05 ] [ 4.7e-06 3.4e-06 4.72e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.313784829056e-14 1.28174129664e-14 5.126965186560001e-15 ] [ -3.652962695424e-14 7.53023011776e-15 9.93349504896e-15 ] [ -5.223095783807999e-14 -3.44467973472e-14 5.44740051072e-15 ] [ 4.822551628608e-14 1.12152363456e-15 -2.931983216064e-14 ] [ 1.44195895872e-15 -8.33131842816e-15 -3.108222644352e-14 ] [ 1.84250311392e-14 1.6021766208e-14 -3.556832098176e-14 ] [ 7.53023011776e-15 5.44740051072e-15 7.562273650176e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.010874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.846966096777458e-18 } }