{ "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" [ [ 1.4555286 -6.0868642 -3.1800035 ] [ -5.8122433 4.8203838 3.3718259 ] [ -1.1814462 -2.9663531 2.7097673 ] [ 0.8699124 2.2388757 -4.9042337 ] [ 1.2915408 1.718228 1.1752734 ] [ 1.6065723 -0.7615895 -1.3395575 ] [ 1.7701353 1.0373194 2.1669281 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.332013913038732e-09 -9.752231595571101e-09 -5.094927303738219e-09 ] [ -9.31224040638305e-09 7.72310629127213e-09 5.40226067089602e-09 ] [ -1.89288549596809e-09 -4.752621625013465e-09 4.341525851637268e-09 ] [ 1.393753320906862e-09 3.587074332970393e-09 -7.857448641815366e-09 ] [ 2.069276491617667e-09 2.752904753484552e-09 1.882995580041735e-09 ] [ 2.574012599891638e-09 -1.220200901599743e-09 -2.146207726399455e-09 ] [ 2.83606941667858e-09 1.661968904674899e-09 3.471801569378014e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.00570306491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.404178682735122e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4932074 1.3257378 1.7390561 ] [ 1.4781147 3.3076274 3.2274593 ] [ 2.4757507 1.4633949 4.5987401 ] [ 2.7376587 3.5973301 1.0288972 ] [ 4.0938932 3.1355019 5.148066 ] [ 4.5215706 1.8510733 3.0311835 ] [ 3.8092228 4.2248176 3.0586437 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4932074e-10 1.3257378e-10 1.7390561e-10 ] [ 1.4781147e-10 3.3076274e-10 3.2274593e-10 ] [ 2.4757507e-10 1.4633949e-10 4.5987401e-10 ] [ 2.7376587e-10 3.5973301e-10 1.0288972e-10 ] [ 4.0938932e-10 3.1355019e-10 5.148066000000001e-10 ] [ 4.521570600000001e-10 1.8510733e-10 3.0311835e-10 ] [ 3.8092228e-10 4.2248176e-10 3.0586437e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.39e-05 -1.84e-05 2.81e-05 ] [ 4.98e-05 -5.61e-05 -1.33e-05 ] [ -2.1e-06 6.84e-05 -8.59e-05 ] [ -6.4e-05 2.34e-05 5.89e-05 ] [ 6.4e-06 -6.8e-06 6.9e-06 ] [ -0.0001216 8.41e-05 2.84e-05 ] [ 6.76e-05 -9.46e-05 -2.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.023790869126e-13 -2.94800500656e-14 4.50211634154e-14 ] [ 7.978839637319999e-14 -8.988210916739999e-14 -2.13089492322e-14 ] [ -3.364570931399999e-15 1.095888817656e-13 -1.376269728606e-13 ] [ -1.02539304576e-13 3.749093323559999e-14 9.436820374259999e-14 ] [ 1.02539304576e-14 -1.08948011112e-14 1.10550187746e-14 ] [ -1.948246786944e-13 1.347430549194e-13 4.550181640559999e-14 ] [ 1.083071404584e-13 -1.515659095764e-13 -3.6850062582e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.14226006491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.906710516396036e-18 } }