{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.54692e-10 0.0 0.0 ] "source-value" [ 5.54692 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.23956e-11 5.520990000000001e-10 0.0 ] "source-value" [ 0.123956 5.52099 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.02669e-11 -1.09883e-11 5.466380000000001e-10 ] "source-value" [ 0.202669 -0.109883 5.46638 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.988775230137452e-09 9.35893849097491e-10 -1.423172316317485e-09 ] [ 4.14761550097655e-10 -9.087834184969344e-11 4.178513477108678e-09 ] [ -4.286365598514451e-10 3.538535241166464e-10 -6.997600919764627e-10 ] [ -3.024941503602816e-11 -1.779048267982568e-09 -3.287676679811973e-09 ] [ -3.676596562975083e-09 9.86941118848124e-10 7.649984809281696e-10 ] [ 8.091664849220737e-09 -3.235131374920892e-09 -1.805202199140507e-09 ] [ -3.285579590833008e-09 5.141951466017977e-09 3.115451024394402e-09 ] [ 2.903410799296963e-09 -2.313581813109423e-09 -8.431518554024833e-10 ] ] "source-value" [ [ -2.4895977 0.584139 -0.8882743 ] [ 0.2588738 -0.0567218 2.608023 ] [ -0.2675339 0.220858 -0.4367559 ] [ -0.0188802 -1.1103946 -2.0520064 ] [ -2.2947511 0.6160002 0.4774745 ] [ 5.05042 -2.0192102 -1.1267186 ] [ -2.0506975 3.2093537 1.9445116 ] [ 1.8121665 -1.4440242 -0.526254 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -3.14992e-14 -4.7744e-13 1.04344e-12 ] [ 1.40487e-10 1.33719e-10 1.19876e-10 ] [ 1.31099e-11 2.68123e-10 2.80213e-10 ] [ 1.67848e-10 4.08836e-10 4.225500000000001e-10 ] [ 2.84099e-10 -8.65799e-12 2.639200000000001e-10 ] [ 4.04763e-10 1.27038e-10 4.03721e-10 ] [ 2.8307e-10 2.64898e-10 -3.39665e-12 ] [ 4.22323e-10 4.11032e-10 1.34741e-10 ] ] "source-value" [ [ -0.000314992 -0.0047744 0.0104344 ] [ 1.40487 1.33719 1.19876 ] [ 0.131099 2.68123 2.80213 ] [ 1.67848 4.08836 4.2255 ] [ 2.84099 -0.0865799 2.6392 ] [ 4.04763 1.27038 4.03721 ] [ 2.8307 2.64898 -0.0339665 ] [ 4.22323 4.11032 1.34741 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.675546616298031e-18 "source-value" -35.423976 } }