{ "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" [ 5.44972 0 0 ] "si-unit" "m" "si-value" [ 5.44972e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0609808 5.45304 0 ] "si-unit" "m" "si-value" [ -6.09808e-12 5.45304e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0674249 -0.145247 5.63878 ] "si-unit" "m" "si-value" [ -6.742489999999999e-12 -1.45247e-11 5.63878e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00897115 -0.00389651 -0.0378043 ] [ 1.32076 1.2724 1.76049 ] [ 0.246678 2.71711 2.69984 ] [ 1.36622 4.37217 4.08545 ] [ 2.70002 -0.0778066 3.30264 ] [ 4.02111 1.29847 4.36135 ] [ 2.82584 3.00896 0.436415 ] [ 4.07612 3.84466 1.60166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.971150000000001e-13 -3.89651e-13 -3.78043e-12 ] [ 1.32076e-10 1.2724e-10 1.76049e-10 ] [ 2.46678e-11 2.71711e-10 2.69984e-10 ] [ 1.36622e-10 4.37217e-10 4.08545e-10 ] [ 2.70002e-10 -7.780660000000001e-12 3.30264e-10 ] [ 4.02111e-10 1.29847e-10 4.36135e-10 ] [ 2.82584e-10 3.00896e-10 4.36415e-11 ] [ 4.076120000000001e-10 3.84466e-10 1.60166e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.35294140000000007 -1.4254301000000003 3.178039000000001 ] [ 10.820256000000002 -6.726893500000002 -7.961962200000002 ] [ -7.652855100000002 7.532715100000002 10.737523000000001 ] [ -23.739835500000005 -18.622600000000002 11.948070000000001 ] [ 19.132378200000005 14.943330400000004 -19.664218100000003 ] [ 2.2645104000000003 7.002741700000001 1.7810781000000004 ] [ -17.391758800000005 -19.232477100000004 -15.142289700000003 ] [ 16.214363500000005 16.528613400000005 15.123760000000004 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.654744595924213e-10 -2.283790780804607e-09 5.091779785790612e-09 ] [ 1.733596119427093e-08 -1.077767149631149e-08 -1.275646969253334e-08 ] [ -1.226122552359005e-08 1.206874002436714e-08 1.720340831590228e-08 ] [ -3.803540941973789e-08 -2.983669433851009e-08 1.914291841768186e-08 ] [ 3.06534490523436e-08 2.394185460376992e-08 -3.15055505061322e-08 ] [ 3.628145620438457e-09 1.121962903324125e-08 2.853601691638886e-09 ] [ -2.786466934395267e-08 -3.081382516969139e-08 -2.426062254272065e-08 ] [ 2.597827412085287e-08 2.648175796372161e-08 2.423093469059022e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -21.537674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.450715774921202e-18 } }