{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.147227 2.362862 2.450911 ] [ 2.622761 1.752099 4.557796 ] [ 1.686581 4.667086 2.204349 ] [ 1.229897 3.438837 4.460251 ] [ 4.850673 1.640741 2.950795 ] [ 3.668046 3.670667 2.833872 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.147227e-10 2.362862e-10 2.450911e-10 ] [ 2.622761e-10 1.752099e-10 4.557796e-10 ] [ 1.686581e-10 4.667086e-10 2.204349e-10 ] [ 1.229897e-10 3.438837e-10 4.460251000000001e-10 ] [ 4.850672999999999e-10 1.640741e-10 2.950795e-10 ] [ 3.668046e-10 3.670667e-10 2.833872e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 9.8734039 -17.4390457 -11.3893377 ] [ 21.4511265 6.5922129 -12.7182947 ] [ -8.7094224 12.1735599 -3.6138527 ] [ -7.5933083 8.1087018 8.0152246 ] [ -19.1502192 1.8167472 4.9544716 ] [ 4.1284195 -11.2521761 14.751789 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.581893702662447e-08 -2.794043153979817e-08 -1.82477307396753e-08 ] [ 3.43684936512782e-08 1.056188947473338e-08 -2.037695459266604e-08 ] [ -1.39540330649162e-08 1.950419322437937e-08 -5.790030354657811e-09 ] [ -1.216582113301826e-08 1.299157255603374e-08 1.284180557038199e-08 ] [ -3.068203373821817e-08 2.910749913724924e-09 7.937938631336593e-09 ] [ 6.614457258249962e-09 -1.802797362907325e-08 2.363497164549822e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -13.036082 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.088610597930799e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0896431 2.1477247 2.3518886 ] [ 2.978243 1.7655086 4.6964319 ] [ 1.6651035 4.6327216 2.0133307 ] [ 1.284561 3.5613269 4.2977028 ] [ 4.54546 1.5787217 2.6914394 ] [ 3.6421744 3.8462885 3.4071806 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0896431e-10 2.1477247e-10 2.3518886e-10 ] [ 2.978243e-10 1.7655086e-10 4.696431900000001e-10 ] [ 1.6651035e-10 4.6327216e-10 2.0133307e-10 ] [ 1.284561e-10 3.5613269e-10 4.2977028e-10 ] [ 4.545460000000001e-10 1.5787217e-10 2.6914394e-10 ] [ 3.6421744e-10 3.8462885e-10 3.4071806e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.26e-05 8.2e-06 2.2e-06 ] [ 2.2e-05 3.54e-05 1.75e-05 ] [ 3.04e-05 1.03e-05 4.32e-05 ] [ -4.19e-05 -3.91e-05 -2.21e-05 ] [ -2.13e-05 -2.08e-05 -1.2e-06 ] [ -1.9e-06 6.1e-06 -3.97e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.01874255884e-14 1.31378483988e-14 3.5247885948e-15 ] [ 3.5247885948e-14 5.671705284359999e-14 2.8038091095e-14 ] [ 4.870616967359999e-14 1.65024193302e-14 6.92140305888e-14 ] [ -6.713120096459999e-14 -6.26451063894e-14 -3.54081036114e-14 ] [ -3.41263623042e-14 -3.332527398719999e-14 -1.9226119608e-15 ] [ -3.0441356046e-15 9.773277467399999e-15 -6.36064123698e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.308234 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.574173126060435e-18 } }