{ "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" [ [ 2.221555 1.50122 1.826509 ] [ 1.576881 2.934657 3.026633 ] [ 2.584327 1.716088 4.47164 ] [ 2.903501 3.607036 1.073051 ] [ 4.2877 3.061946 5.191695 ] [ 4.423391 1.863673 3.155042 ] [ 3.612063 4.220863 3.087476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.221555e-10 1.50122e-10 1.826509e-10 ] [ 1.576881e-10 2.934657e-10 3.026633e-10 ] [ 2.584327e-10 1.716088e-10 4.47164e-10 ] [ 2.903501e-10 3.607036e-10 1.073051e-10 ] [ 4.2877e-10 3.061946e-10 5.191695e-10 ] [ 4.423391e-10 1.863673e-10 3.155042e-10 ] [ 3.612063e-10 4.220863e-10 3.087476e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3027832 -8.6038735 -8.7333326 ] [ -13.4027206 5.64334 4.6713009 ] [ -4.4671519 -7.2334271 10.1354754 ] [ 1.3260807 3.6893584 -8.2157947 ] [ 2.4052301 2.3736412 5.292409 ] [ 11.4144885 -6.7035211 -2.6886117 ] [ 4.0268563 10.8344822 -0.4614464 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.087288785011011e-09 -1.378492497002067e-08 -1.399234131339048e-08 ] [ -2.147352560043455e-08 9.041627411225472e-09 7.484249090702e-09 ] [ -7.1571663357423e-09 -1.158922778788114e-08 1.623882172657353e-08 ] [ 2.124615494834099e-09 5.911003774232096e-09 -1.316315418963255e-08 ] [ 3.853603433864446e-09 3.802992436807657e-09 8.479373967511508e-09 ] [ 1.828802661309046e-08 -1.07402247834595e-08 -4.307630808149343e-09 ] [ 6.451735019181192e-09 1.735875407931375e-08 -7.393186338323252e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -1.192586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.910733407493389e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5940938 1.6730321 1.5957983 ] [ 1.2689924 2.7378765 3.3330355 ] [ 2.3426985 1.9800214 5.3317911 ] [ 3.4274467 3.828713 0.9781541 ] [ 4.3762926 2.9259383 4.4995325 ] [ 4.544139 1.232078 2.8582946 ] [ 3.0557549 4.5278237 3.2354399 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5940938e-10 1.6730321e-10 1.5957983e-10 ] [ 1.2689924e-10 2.7378765e-10 3.3330355e-10 ] [ 2.3426985e-10 1.9800214e-10 5.331791100000001e-10 ] [ 3.4274467e-10 3.828713e-10 9.781541e-11 ] [ 4.3762926e-10 2.9259383e-10 4.4995325e-10 ] [ 4.544139e-10 1.232078e-10 2.8582946e-10 ] [ 3.0557549e-10 4.5278237e-10 3.2354399e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.5e-06 -1.14e-05 1.5e-06 ] [ -2.23e-05 1.9e-06 -2.5e-06 ] [ 7.6e-06 4.2e-06 4.4e-06 ] [ 3.15e-05 -7.9e-06 1.76e-05 ] [ 1.53e-05 1.85e-05 -1.38e-05 ] [ -2.03e-05 -7e-07 -2.13e-05 ] [ -1.94e-05 -4.7e-06 1.41e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.2016324656e-14 -1.826481347712e-14 2.4032649312e-15 ] [ -3.572853864384e-14 3.04413557952e-15 -4.005441552e-15 ] [ 1.217654231808e-14 6.72914180736e-15 7.04957713152e-15 ] [ 5.04685635552e-14 -1.265719530432e-14 2.819830852608e-14 ] [ 2.451330229824e-14 2.96402674848e-14 -2.211003736704e-14 ] [ -3.252418540224e-14 -1.12152363456e-15 -3.412636202304e-14 ] [ -3.108222644352e-14 -7.53023011776e-15 2.259069035328e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.906007 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.907552606248115e-18 } }