{ "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" [ [ 3.1749668 -10.4398368 -7.0962306 ] [ -8.7444744 9.2149616 5.8278461 ] [ -2.6070404 -4.2775372 4.9752906 ] [ 0.5826358 1.8881989 -5.5571791 ] [ 1.9115991 2.3392552 3.0798305 ] [ 3.33776 -2.0948379 -3.5960794 ] [ 2.3445531 3.3697961 2.366522 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.08685762068575e-09 -1.672646258373333e-08 -1.13694148567958e-08 ] [ -1.401019256029117e-08 1.476399615872725e-08 9.337238847968026e-09 ] [ -4.176939212774013e-09 -6.853370152905785e-09 7.97129434667984e-09 ] [ 9.334854648918972e-10 3.025228157924502e-09 -8.903582504973148e-09 ] [ 3.062719411595429e-09 3.747900022402997e-09 4.934432463780536e-09 ] [ 5.347681081899839e-09 -3.356300335397628e-09 -5.761554388688739e-09 ] [ 3.756388193992265e-09 5.399008572764326e-09 3.791586252246947e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.223518 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.798205829087841e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7283078 1.4485901 1.3542723 ] [ 1.4191901 2.8994518 3.0665411 ] [ 2.3892251 1.7955677 4.9908542 ] [ 2.5421089 3.900117 0.8920061 ] [ 4.4544914 3.1810082 5.2621166 ] [ 4.2695946 1.5110803 3.2205516 ] [ 3.8065002 4.1696679 3.0457042 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7283078e-10 1.4485901e-10 1.3542723e-10 ] [ 1.4191901e-10 2.8994518e-10 3.0665411e-10 ] [ 2.3892251e-10 1.7955677e-10 4.9908542e-10 ] [ 2.5421089e-10 3.900117e-10 8.920061e-11 ] [ 4.4544914e-10 3.1810082e-10 5.2621166e-10 ] [ 4.2695946e-10 1.5110803e-10 3.2205516e-10 ] [ 3.8065002e-10 4.1696679e-10 3.0457042e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.7e-06 -2.86e-05 -1.82e-05 ] [ -2.16e-05 -9.26e-05 1.18e-05 ] [ 2.78e-05 8.32e-05 -5.21e-05 ] [ 1.9e-06 -1.22e-05 -2.09e-05 ] [ 1.5e-05 -1.39e-05 -5e-06 ] [ -5.45e-05 -6.66e-05 -8.8e-06 ] [ 3.82e-05 0.0001307 9.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.07345834478e-14 -4.58222517324e-14 -2.915961473879999e-14 ] [ -3.46070152944e-14 -1.483615563084e-13 1.89056842812e-14 ] [ 4.454051042519999e-14 1.333010959488e-13 -8.347340263139999e-14 ] [ 3.0441356046e-15 -1.95465549348e-14 -3.34854916506e-14 ] [ 2.403264951e-14 -2.22702552126e-14 -8.010883169999999e-15 ] [ -8.7318626553e-14 -1.067049638244e-13 -1.40991543792e-14 ] [ 6.12031474188e-14 2.094044860638e-13 1.493228622888e-13 ] ] } "relaxed-potential-energy" { "source-value" -16.78446 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.689166962630764e-18 } }