{ "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" [ [ -0.08595790000000002 -0.033009500000000004 0.36593440000000005 ] [ 0.3260871000000001 -0.5115416000000002 -0.6772541000000001 ] [ -0.2538077000000001 0.10553890000000003 0.5056007000000001 ] [ -0.7250617000000001 -0.9311283000000002 0.7724591000000002 ] [ 0.9346669000000002 0.45062190000000013 -0.6819430000000001 ] [ 0.19148190000000007 0.7365406000000001 0.18293870000000004 ] [ -0.7984568000000002 -0.43800830000000013 -0.8276017000000002 ] [ 0.4110482000000001 0.6209862000000002 0.35986590000000007 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.377197377530644e-10 -5.288704916429761e-11 5.862915404264756e-10 ] [ 5.224491279644718e-10 -8.195799920866256e-10 -1.085080685360945e-09 ] [ -4.066447631190203e-10 1.690919581649492e-10 8.100616210001148e-10 ] [ -1.161676904377503e-09 -1.491831993225249e-09 1.23761591054421e-09 ] [ 1.497501455415612e-09 7.219758730004757e-10 -1.092593131318215e-09 ] [ 3.067878234863636e-10 1.180068129590005e-09 2.93100108179545e-10 ] [ -1.279268817678782e-09 -7.017666579763528e-10 -1.325964095074336e-09 ] [ 6.585718160619226e-10 9.949295714794334e-10 5.765687316031509e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 29.536237 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.732226838780793e-18 } }