{ "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" [ 5.52208 0 0 ] "si-unit" "m" "si-value" [ 5.52208e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0968577 5.45697 0 ] "si-unit" "m" "si-value" [ -9.68577e-12 5.456970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.137264 0.147448 5.57607 ] "si-unit" "m" "si-value" [ 1.37264e-11 1.47448e-11 5.57607e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0138032 0.0341723 -0.113332 ] [ 1.31844 1.45238 1.31404 ] [ 0.0088982 2.79356 2.65987 ] [ 1.44046 4.10222 4.12461 ] [ 2.80067 0.127474 2.69388 ] [ 4.04292 1.57371 4.10996 ] [ 2.66616 2.79739 -0.110182 ] [ 4.02446 4.16186 1.2374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.38032e-12 3.41723e-12 -1.13332e-11 ] [ 1.31844e-10 1.45238e-10 1.31404e-10 ] [ 8.8982e-13 2.79356e-10 2.65987e-10 ] [ 1.44046e-10 4.10222e-10 4.12461e-10 ] [ 2.80067e-10 1.27474e-11 2.69388e-10 ] [ 4.04292e-10 1.57371e-10 4.10996e-10 ] [ 2.66616e-10 2.79739e-10 -1.10182e-11 ] [ 4.024460000000001e-10 4.16186e-10 1.2374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1112992 0.2264784 -0.4867789 ] [ 0.4946356 -0.7433718 -0.3951291 ] [ -0.8150091 0.8131045 0.4712894 ] [ -1.5034152 1.7767766 -1.0999901 ] [ -0.3719457 -0.3265701 -0.202343 ] [ 1.6859392 -1.0211522 -0.366138 ] [ 0.1872749 -0.6889398 1.1447425 ] [ 0.4338195 -0.0363255 0.9343472 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.783209776228928e-10 3.628584005857055e-10 -7.799057795042225e-10 ] [ 7.924936006645704e-10 -1.191012928334521e-09 -6.330666114334494e-10 ] [ -1.305788536517369e-09 1.302737030900253e-09 7.550888645318795e-10 ] [ -2.408736704640437e-09 2.846709952357964e-09 -1.762378435851323e-09 ] [ -5.959227096567737e-10 -5.232229835830433e-10 -3.24189226653462e-10 ] [ 2.701172392584652e-09 -1.636066194597695e-09 -5.866177484194919e-10 ] [ 3.000474689146866e-10 -1.103803249792633e-09 1.834079685446745e-09 ] [ 6.95055466273563e-10 -5.819986731836699e-11 1.496989251883325e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.434113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.837388452911564e-18 } }