{ "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" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 10.1770973 5.8325882 -5.9242331 ] [ 1.9212406 -6.3480794 8.5424171 ] [ 8.5994032 -4.1224863 0.8865989 ] [ 0.8451861 4.7360724 1.047522 ] [ -8.4399385 2.2994967 -6.269774 ] [ -6.491946 2.7234781 6.6968451 ] [ -6.6110427 -5.1210697 -4.979376 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.63055073616668e-08 9.344836452793955e-09 -9.49166776898951e-09 ] [ 3.078166772251765e-09 -1.017074440166209e-08 1.368646096274214e-08 ] [ 1.377776275987271e-08 -6.604951169428295e-09 1.420488029606997e-09 ] [ 1.354137409645131e-09 7.588024473696146e-09 1.678315258173658e-09 ] [ -1.352227214568982e-08 3.684199852346752e-09 -1.00452853204997e-08 ] [ -1.040124410469608e-08 4.363492939080805e-09 1.072952865233904e-08 ] [ -1.059205805305051e-08 -8.20485814682727e-09 -7.977839813372621e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.9348544 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.431521482993201e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.548665 1.8631173 5.2110619 ] [ 3.2505089 4.8528238 3.364017 ] [ 5.36639 0.2033758 2.5990255 ] [ 3.9496881 3.2662202 1.9967679 ] [ 3.4510393 1.2254444 1.349387 ] [ 3.5706354 0.4690159 3.8468733 ] [ 2.5518014 4.0682295 5.3020454 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.548665e-10 1.8631173e-10 5.2110619e-10 ] [ 3.2505089e-10 4.852823800000001e-10 3.364017e-10 ] [ 5.36639e-10 2.033758e-11 2.5990255e-10 ] [ 3.9496881e-10 3.2662202e-10 1.9967679e-10 ] [ 3.4510393e-10 1.2254444e-10 1.349387e-10 ] [ 3.5706354e-10 4.690159e-11 3.8468733e-10 ] [ 2.5518014e-10 4.0682295e-10 5.3020454e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0202245 0.2753642 0.2072399 ] [ 0.3590752 -0.380997 -0.395503 ] [ -0.3193693 -0.0697678 0.160354 ] [ -0.2456609 0.7264489 0.1466722 ] [ 0.0825391 -0.135942 -0.1351382 ] [ 0.326088 -0.0789629 -0.0759998 ] [ -0.1824476 -0.3361434 0.092375 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.24032210673696e-11 4.411820834452954e-10 3.320349226769299e-10 ] [ 5.753018905490842e-10 -6.104244859949376e-10 -6.336656600562624e-10 ] [ -5.116860258612615e-10 -1.117803380446503e-10 2.569154298517632e-10 ] [ -3.935921506246867e-10 1.163899443785877e-09 2.349947697613018e-10 ] [ 1.322422163218733e-10 -2.178030941847936e-10 -2.165152646169946e-10 ] [ 5.224505699234304e-10 -1.265125122905683e-10 -1.217651027454759e-10 ] [ -2.9231327924107e-10 -5.385610967162227e-10 1.480010653464e-10 ] ] } "relaxed-potential-energy" { "source-value" -15.594694 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.498545413533004e-18 } }