{ "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" [ [ 1.891577 1.147444 4.176951 ] [ 1.947528 5.315412 2.001915 ] [ 3.037668 3.274696 0.9821769 ] [ 1.344392 3.383525 2.90788 ] [ 3.679276 1.837825 2.704146 ] [ 4.016034 4.351153 3.141989 ] [ 3.129852 3.103182 4.716137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.891577e-10 1.147444e-10 4.176951e-10 ] [ 1.947528e-10 5.315412000000001e-10 2.001915e-10 ] [ 3.037668e-10 3.274696e-10 9.821769000000001e-11 ] [ 1.344392e-10 3.383525e-10 2.90788e-10 ] [ 3.679276000000001e-10 1.837825e-10 2.704146e-10 ] [ 4.016034e-10 4.351153e-10 3.141989e-10 ] [ 3.129852e-10 3.103182e-10 4.716137e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6668177 -1.8916965 0.3304936 ] [ 0.2623414 3.3895239 -1.0776008 ] [ 0.4190825 -0.0823525 -2.8959704 ] [ -9.0954708 -1.8321875 1.2530624 ] [ 4.3420784 -4.7823067 -1.6197148 ] [ 5.9039554 4.7954382 -1.0897641 ] [ -0.1651692 0.4035813 5.099494 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.670536350075628e-09 -3.030831905949187e-09 5.295091192440269e-10 ] [ 4.203172577479411e-10 5.430615948222836e-09 -1.726506808315376e-09 ] [ 6.71444183686416e-10 -1.31943250164432e-10 -4.639856069408825e-09 ] [ -1.457255067092907e-08 -2.935487977422e-09 2.007627281683538e-09 ] [ 6.956776498160672e-09 -7.6620999882352e-09 -2.595069184923748e-09 ] [ 9.459179312125913e-09 7.683138970531235e-09 -1.745994563207153e-09 ] [ -2.646302307162393e-10 6.46608523452071e-10 8.170290064709876e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.928559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.231601159123343e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6792064 1.1026762 4.043812 ] [ 1.8981483 5.4405461 1.9444963 ] [ 3.1957295 3.2187982 1.3354051 ] [ 1.0902562 3.3238452 3.0292446 ] [ 3.7723884 1.294677 2.6873227 ] [ 4.0643481 4.9299914 3.0869709 ] [ 3.3462501 3.1027028 4.5039434 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6792064e-10 1.1026762e-10 4.043812e-10 ] [ 1.8981483e-10 5.4405461e-10 1.9444963e-10 ] [ 3.1957295e-10 3.2187982e-10 1.3354051e-10 ] [ 1.0902562e-10 3.3238452e-10 3.0292446e-10 ] [ 3.7723884e-10 1.294677e-10 2.6873227e-10 ] [ 4.0643481e-10 4.929991399999999e-10 3.0869709e-10 ] [ 3.3462501e-10 3.1027028e-10 4.5039434e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.7e-06 8.9e-06 -1.1e-06 ] [ -4.1e-06 -5e-06 -2.6e-06 ] [ 9.7e-06 9.1e-06 2.8e-06 ] [ 5e-07 -6.6e-06 1.14e-05 ] [ 1.4e-06 5.1e-06 2.6e-06 ] [ 5e-07 -6.4e-06 -2.6e-06 ] [ -1.4e-06 -5.1e-06 -1.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.073458335936e-14 1.425937192512e-14 -1.76239428288e-15 ] [ -6.568924145279999e-15 -8.010883104e-15 -4.16565921408e-15 ] [ 1.554111322176e-14 1.457980724928e-14 4.48609453824e-15 ] [ 8.010883104e-16 -1.057436569728e-14 1.826481347712e-14 ] [ 2.24304726912e-15 8.17110076608e-15 4.16565921408e-15 ] [ 8.010883104e-16 -1.025393037312e-14 -4.16565921408e-15 ] [ -2.24304726912e-15 -8.17110076608e-15 -1.666263685632e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.78446 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.689166940475277e-18 } }