{ "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" [ [ 2.4283511 -9.1667172 -6.8734429 ] [ -7.4205194 8.411406 5.1401342 ] [ -2.4638937 -3.9434094 4.1194923 ] [ 0.1007379 0.9723831 -5.0805488 ] [ 1.941735 2.3649927 3.1045217 ] [ 3.1846511 -1.5982727 -3.0604979 ] [ 2.2289379 2.9596174 2.6503414 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.890647391568197e-09 -1.468670010832591e-08 -1.10124696095132e-08 ] [ -1.18889827948237e-08 1.34765581522874e-08 8.235402910864283e-09 ] [ -3.947592914799805e-09 -6.318038398975959e-09 6.600154307002918e-09 ] [ 1.613999095382286e-10 1.557929482116485e-09 -8.139936575256738e-09 ] [ 3.11100244641999e-09 3.789136043520571e-09 4.973992127485957e-09 ] [ 5.102373579862396e-09 -2.560715174700092e-09 -4.903458223786069e-09 ] [ 3.571152222017028e-09 4.741829843859832e-09 4.246315063202846e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.870841 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.741700744212919e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2524797 1.3698295 1.6861292 ] [ 1.4545993 3.0833036 3.1111836 ] [ 2.5295131 1.6306461 4.5661491 ] [ 2.9146703 3.5972689 0.9906213 ] [ 4.336787 3.1069987 5.2484283 ] [ 4.492786 1.8369337 3.1007321 ] [ 3.6285828 4.2805025 3.1288024 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2524797e-10 1.3698295e-10 1.6861292e-10 ] [ 1.4545993e-10 3.0833036e-10 3.1111836e-10 ] [ 2.5295131e-10 1.6306461e-10 4.5661491e-10 ] [ 2.9146703e-10 3.5972689e-10 9.906213000000001e-11 ] [ 4.336787e-10 3.1069987e-10 5.2484283e-10 ] [ 4.492786e-10 1.8369337e-10 3.1007321e-10 ] [ 3.6285828e-10 4.2805025e-10 3.1288024e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.2176426 -0.1420836 -1.2716887 ] [ -0.5140849 0.6198654 0.5779373 ] [ -0.4064467 -0.6644773 0.8996338 ] [ 0.4157452 -0.5490238 -0.5090721 ] [ 0.556205 0.1970898 0.3254457 ] [ 0.5842526 -0.1715261 -0.0998095 ] [ -0.4180284 0.7101555 0.0775535 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.487018882830084e-10 -2.276430239946024e-10 -2.037469920861835e-09 ] [ -8.236548146722264e-10 9.931338601050636e-10 9.259576379770481e-10 ] [ -6.511994057064077e-10 -1.064610003883408e-09 1.441372253516629e-09 ] [ 6.660972451376567e-10 -8.796331038698891e-10 -8.156234236413114e-10 ] [ 8.911386547139698e-10 3.157726723597332e-10 5.214214961757737e-10 ] [ 9.360758640737484e-10 -2.748151095411474e-10 -1.59912448751223e-10 ] [ -6.697553348284056e-10 1.137794548606587e-09 1.24254405584919e-10 ] ] } "relaxed-potential-energy" { "source-value" -13.638714 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.185162888860867e-18 } }