{ "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" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6547472 0.9054966 1.3407274 ] [ 1.2852004 -0.7970366 -0.0356494 ] [ -2.1425932 2.1838302 0.4668662 ] [ -5.7436484 2.0806687 -3.1543961 ] [ 2.3632592 -3.2779522 0.6358317 ] [ 0.5972493 -4.7804021 -4.8375589 ] [ 2.9857855 3.6853955 5.5841791 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.049020665016925e-09 1.450765494686444e-09 2.148082112843571e-09 ] [ 2.059118050887453e-09 -1.276993416962804e-09 -5.711663569611959e-11 ] [ -3.432812761207288e-09 3.498881719063546e-09 7.480021168443707e-10 ] [ -9.202339260391483e-09 3.333598774235155e-09 -5.053899725800727e-09 ] [ 3.786358670325533e-09 -5.251858422208895e-09 1.018714692896498e-09 ] [ 9.568988731328562e-10 -7.65904854574453e-09 -7.750623835178743e-09 ] [ 4.783755762236006e-09 5.904654557148746e-09 8.94684127409115e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.654065 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.270452014411721e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5308352 2.8980971 1.4917279 ] [ 1.9576124 1.1354134 2.9157115 ] [ 1.212674 3.1765587 3.8645023 ] [ 2.0389249 4.9245036 2.5025697 ] [ 3.4277442 2.4084059 4.1841924 ] [ 3.7900539 3.3351605 2.0374119 ] [ 3.7927434 4.6923739 3.9814775 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5308352e-10 2.8980971e-10 1.4917279e-10 ] [ 1.9576124e-10 1.1354134e-10 2.9157115e-10 ] [ 1.212674e-10 3.1765587e-10 3.8645023e-10 ] [ 2.0389249e-10 4.9245036e-10 2.5025697e-10 ] [ 3.4277442e-10 2.4084059e-10 4.1841924e-10 ] [ 3.790053900000001e-10 3.3351605e-10 2.0374119e-10 ] [ 3.7927434e-10 4.6923739e-10 3.9814775e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.8e-06 3.24e-05 -1.07e-05 ] [ 4.4e-05 2.68e-05 5.2e-06 ] [ 5.46e-05 2.87e-05 -2.18e-05 ] [ 1.17e-05 -2.19e-05 -6e-06 ] [ 6.3e-06 -3.69e-05 -5.8e-06 ] [ -8.21e-05 -1.66e-05 7.46e-05 ] [ -3.74e-05 -1.26e-05 -3.54e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.486094575199999e-15 5.19105229416e-14 -1.71432899838e-14 ] [ 7.049577189599999e-14 4.293833379119999e-14 8.331318496799998e-15 ] [ 8.74788442164e-14 4.598246939579999e-14 -3.492745062119999e-14 ] [ 1.87454666178e-14 -3.50876682846e-14 -9.613059803999999e-15 ] [ 1.00937127942e-14 -5.91203177946e-14 -9.2926244772e-15 ] [ -1.315387016514e-13 -2.65961321244e-14 1.195223768964e-13 ] [ -5.99214061116e-14 -2.01874255884e-14 -5.671705284359999e-14 ] ] } "relaxed-potential-energy" { "source-value" -30.311325 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.856409666058004e-18 } }