{ "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" [ [ 2.666012 2.519902 1.694639 ] [ 2.496155 4.523544 1.233674 ] [ 4.888558 1.942791 1.748689 ] [ 3.394286 2.23286 3.870587 ] [ 4.049493 3.873676 2.828862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.666012e-10 2.519902e-10 1.694639e-10 ] [ 2.496155e-10 4.523544000000001e-10 1.233674e-10 ] [ 4.888558e-10 1.942791e-10 1.748689e-10 ] [ 3.394286e-10 2.23286e-10 3.870587e-10 ] [ 4.049493e-10 3.873676e-10 2.828862e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2010036 -3.9627334 -0.4402569 ] [ -0.4146172 3.313884 -0.8534158 ] [ 0.3217108 -0.1527284 0.2134951 ] [ -0.9638213 -3.220467 2.2005385 ] [ 2.2577313 4.0220448 -1.1203608 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.924219889416635e-09 -6.348998807943295e-09 -7.053693123258836e-10 ] [ -6.642899844215578e-10 5.309427468843186e-09 -1.367322842581329e-09 ] [ 5.154375224188647e-10 -2.446978718121907e-10 3.420568578753581e-10 ] [ -1.544211953489063e-09 -5.159756935457913e-09 3.525651337870301e-09 ] [ 3.617284304908391e-09 6.444026146370211e-09 -1.795015880620785e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.698882 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.874367522989794e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.178049 2.0470049 1.7224352 ] [ 3.0174333 4.2133404 1.1199254 ] [ 4.5375475 2.4386173 1.6370708 ] [ 3.4610532 2.1137321 3.7497622 ] [ 4.300421 4.2800783 3.1472573 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.178049e-10 2.0470049e-10 1.7224352e-10 ] [ 3.0174333e-10 4.2133404e-10 1.1199254e-10 ] [ 4.5375475e-10 2.4386173e-10 1.6370708e-10 ] [ 3.4610532e-10 2.1137321e-10 3.7497622e-10 ] [ 4.300421e-10 4.2800783e-10 3.1472573e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.61e-05 -1.4e-06 7.7e-06 ] [ -1.48e-05 1.35e-05 -1.27e-05 ] [ -1.7e-05 -3.1e-06 1.83e-05 ] [ -1.4e-06 9.3e-06 -1.61e-05 ] [ 7.1e-06 -1.84e-05 2.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.181680980288e-14 -2.24304726912e-15 1.233675998016e-14 ] [ -2.371221398784e-14 2.16293843808e-14 -2.034764308416e-14 ] [ -2.72370025536e-14 -4.96674752448e-15 2.931983216064e-14 ] [ -2.24304726912e-15 1.490024257344e-14 -2.579504359488e-14 ] [ 1.137545400768e-14 -2.948004982272e-14 4.32587687616e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.137319633913408e-18 } }