{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.37928 0 0 ] "si-unit" "m" "si-value" [ 5.37928e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.109609 5.36452 0 ] "si-unit" "m" "si-value" [ -1.09609e-11 5.36452e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.116688 0.583163 5.41925 ] "si-unit" "m" "si-value" [ -1.16688e-11 5.83163e-11 5.41925e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.149607 0.163517 0.168021 ] [ 1.37749 1.37328 1.35818 ] [ 0.000964456 2.92001 2.60942 ] [ 1.4682 4.32928 3.69686 ] [ 2.55926 -0.0770152 2.34173 ] [ 4.30694 1.43375 4.42217 ] [ 2.84059 2.75554 0.271651 ] [ 3.86093 4.12935 1.26521 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.49607e-11 1.63517e-11 1.68021e-11 ] [ 1.37749e-10 1.37328e-10 1.35818e-10 ] [ 9.64456e-14 2.92001e-10 2.60942e-10 ] [ 1.4682e-10 4.32928e-10 3.69686e-10 ] [ 2.55926e-10 -7.70152e-12 2.34173e-10 ] [ 4.30694e-10 1.43375e-10 4.422170000000001e-10 ] [ 2.84059e-10 2.75554e-10 2.71651e-11 ] [ 3.86093e-10 4.12935e-10 1.26521e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 670.0502315999998 -566.3956745999999 964.3041138999998 ] [ -6.9450088999999995 7.889290399999999 -4.125579299999999 ] [ 0.16243379999999996 -0.7092564999999998 -1.0179278999999999 ] [ -31.450882799999995 -32.396114299999994 44.49978279999999 ] [ 31.430184499999996 28.900903899999996 -35.77936089999999 ] [ -667.5302658999999 570.6175144999999 -964.9369359999998 ] [ -20.969171499999998 -27.789637499999998 -20.895721399999996 ] [ 25.252478999999997 19.882974099999995 17.951628899999996 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.073538815831145e-06 -9.074659079663642e-07 1.54498550663184e-06 ] [ -1.112713089082792e-08 1.264003663358188e-08 -6.609906701716428e-09 ] [ 2.60247636787703e-10 -1.136354182450435e-09 -1.63090028304004e-09 ] [ -5.038986912568083e-08 -5.190429693622454e-08 7.129651163283795e-08 ] [ 5.035670679333053e-08 4.630435254856754e-08 -5.732485554114564e-08 ] [ -1.069501385701387e-06 9.142300411509048e-07 -1.545999399405586e-06 ] [ -3.359631633484566e-08 -4.452390750300696e-08 -3.347863630183024e-08 ] [ 4.045893147104296e-08 3.185603625499191e-08 2.876168012885762e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 98.107057 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.57184833060893e-17 } }