{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.086446 2.17872 1.239282 ] [ 2.929314 1.55844 2.269162 ] [ 0.8330856 2.151385 3.328528 ] [ 0.5041522 4.058533 2.531522 ] [ 2.750614 3.605463 1.493085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.086446e-10 2.17872e-10 1.239282e-10 ] [ 2.929314e-10 1.55844e-10 2.269162e-10 ] [ 8.330856e-11 2.151385e-10 3.328528e-10 ] [ 5.041522000000001e-11 4.058533e-10 2.531522e-10 ] [ 2.750614e-10 3.605463e-10 1.493085e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5529017 -1.2816807 -4.9001228 ] [ 2.0154909 -2.328861 1.5309332 ] [ -0.4268775 -3.1952519 4.9182149 ] [ -0.3813097 3.5073907 -0.9059786 ] [ 1.345598 3.2984029 -0.6430468 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.090199418940575e-09 -2.053478852870578e-09 -7.850862189209035e-09 ] [ 3.229172399415151e-09 -3.731246647292909e-09 2.45282538104653e-09 ] [ -6.839331504455521e-10 -5.11935789174678e-09 7.87984892885021e-09 ] [ -6.109254866242617e-10 5.619459379551346e-09 -1.451537731865115e-09 ] [ 2.155885656595238e-09 5.28462401235892e-09 -1.030274549040254e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.632562 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.344394873880649e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9491965 2.1416547 1.0413945 ] [ 2.9152244 1.5972979 2.4174933 ] [ 0.812791 1.9460467 3.4905818 ] [ 0.6619484 4.1081145 2.4925451 ] [ 2.7644516 3.7594271 1.4195642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.491965e-11 2.1416547e-10 1.0413945e-10 ] [ 2.9152244e-10 1.5972979e-10 2.4174933e-10 ] [ 8.127910000000001e-11 1.9460467e-10 3.4905818e-10 ] [ 6.619484e-11 4.1081145e-10 2.4925451e-10 ] [ 2.7644516e-10 3.7594271e-10 1.4195642e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-05 2.25e-05 9.8e-06 ] [ 2.75e-05 3.58e-05 1.88e-05 ] [ -3.84e-05 -2.91e-05 3.5e-06 ] [ 4.69e-05 -3.33e-05 -1.67e-05 ] [ 4.1e-06 4.1e-06 -1.54e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.4087064832e-14 3.604897396800001e-14 1.570133088384e-14 ] [ 4.4059857072e-14 5.735792302464001e-14 3.012092047104e-14 ] [ -6.152358223872e-14 -4.662333966527999e-14 5.6076181728e-15 ] [ 7.514208351552e-14 -5.335248147264001e-14 -2.675634956736e-14 ] [ 6.568924145279999e-15 6.568924145279999e-15 -2.467351996032e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }