{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.549703e-11 7.681545e-11 3.452569e-11 ] [ 6.661644e-11 6.844463e-11 3.568337e-10 ] [ 5.170260000000001e-12 2.4386501e-10 2.0203098e-10 ] [ 2.3155233e-10 -2.564874e-11 9.246563e-11 ] [ 2.9531825e-10 9.879001e-11 2.8426227e-10 ] [ 2.3311583e-10 3.2106114e-10 2.1494161e-10 ] ] "source-value" [ [ 0.2549703 0.7681545 0.3452569 ] [ 0.6661644 0.6844463 3.568337 ] [ 0.0517026 2.4386501 2.0203098 ] [ 2.3155233 -0.2564874 0.9246563 ] [ 2.9531825 0.9879001 2.8426227 ] [ 2.3311583 3.2106114 2.1494161 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.0740176356256e-12 2.387243164992e-13 -3.7843411783296e-12 ] [ 8.7190451703936e-13 -2.0435762798304e-12 5.55570765028608e-12 ] [ -5.90770585387584e-12 3.52751226601536e-12 -2.1036579031104e-12 ] [ -3.12360353991168e-12 1.8481107320928e-12 -2.04710106839616e-12 ] [ 6.97123069476288e-12 -3.55298687428608e-12 5.597684677751039e-12 ] [ -8.858434536403202e-13 -1.778416049088e-14 -3.21829217820096e-12 ] ] "source-value" [ [ 0.0012945 0.000149 -0.002362 ] [ 0.0005442 -0.0012755 0.0034676 ] [ -0.0036873 0.0022017 -0.001313 ] [ -0.0019496 0.0011535 -0.0012777 ] [ 0.0043511 -0.0022176 0.0034938 ] [ -0.0005529 -1.11e-05 -0.0020087 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.421354947207791e-18 "source-value" -15.112909 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.315530881137348e-09 -1.853291049760833e-09 -5.171539983197925e-09 ] [ -7.737840965371574e-09 -2.846717346982268e-08 1.84394997553918e-08 ] [ -1.079318393057173e-08 2.691595071187632e-08 -6.561936572383706e-09 ] [ -2.038276231503495e-08 -5.787828051102602e-08 -5.907252197565661e-08 ] [ 3.680097767500985e-08 3.87545707490686e-08 5.544281695671312e-08 ] [ 3.428340417105757e-09 2.252822372988228e-08 -3.076318180866686e-09 ] ] "source-value" [ [ -0.8210898 -1.1567333 -3.2278214 ] [ -4.8295805 -17.7678123 11.5090306 ] [ -6.7365756 16.7996152 -4.0956387 ] [ -12.7219197 -36.1247816 -36.8701685 ] [ 22.9693638 24.1887007 34.6046848 ] [ 2.1398018 14.0610114 -1.9200868 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 9.8761880751519e-19 "source-value" 6.1642318 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.515051e-11 6.129927e-11 4.125648000000001e-11 ] [ 5.354239e-11 8.367141000000001e-11 2.920626e-10 ] [ 3.803736e-12 2.448484e-10 2.393252e-10 ] [ 2.476891e-10 3.707144e-12 1.494005e-10 ] [ 2.980221e-10 9.767319e-11 2.515602e-10 ] [ 2.390623e-10 2.921281e-10 2.114549e-10 ] ] "source-value" [ [ 0.1515051 0.6129927 0.4125648 ] [ 0.5354239 0.8367141 2.920626 ] [ 0.03803736 2.448484 2.393252 ] [ 2.476891 0.03707144 1.494005 ] [ 2.980221 0.9767319 2.515602 ] [ 2.390623 2.921281 2.114549 ] ] } "instance-id" 1 }