{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.42446e-10 0.0 0.0 ] "source-value" [ 5.42446 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.25581e-13 5.46076e-10 0.0 ] "source-value" [ -0.00225581 5.46076 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.17255e-12 3.43157e-12 5.56103e-10 ] "source-value" [ -0.0117255 0.0343157 5.56103 ] } "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" [ [ -1.251943695411038e-09 9.05357964881664e-12 3.179093324996467e-10 ] [ -8.522285063946395e-10 1.388217308546168e-09 -3.020975475595688e-09 ] [ -1.717778951173569e-09 7.767353859815022e-10 8.079408198071616e-11 ] [ 3.152508728762857e-09 8.620006622578848e-10 2.678687103198624e-10 ] [ 6.796931502362669e-10 -3.485968467108665e-09 2.543703242243238e-09 ] [ -1.929334678060877e-10 8.924021238552268e-10 1.766654790950031e-09 ] [ -6.118786214959757e-10 -4.594018757593709e-10 -1.817243677969453e-09 ] [ 7.945613632821849e-10 1.69614427960992e-11 -1.387113248636774e-10 ] ] "source-value" [ [ -0.7814018 0.0056508 0.1984234 ] [ -0.5319192 0.8664571 -1.8855446 ] [ -1.0721533 0.4848001 0.0504277 ] [ 1.9676412 0.5380185 0.1671905 ] [ 0.4242311 -2.1757704 1.5876547 ] [ -0.1204196 0.5569936 1.1026592 ] [ -0.3819046 -0.2867361 -1.1342343 ] [ 0.4959262 0.0105865 -0.0865768 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.82071e-12 1.39191e-13 1.64222e-12 ] [ 1.32892e-10 1.32964e-10 1.49498e-10 ] [ -5.098020000000001e-13 2.67752e-10 2.7579e-10 ] [ 1.15566e-10 4.0451e-10 4.18086e-10 ] [ 2.64397e-10 1.06198e-11 2.73506e-10 ] [ 4.036990000000001e-10 1.34406e-10 4.11378e-10 ] [ 2.695e-10 2.72586e-10 1.09097e-11 ] [ 4.009330000000001e-10 4.13019e-10 1.43696e-10 ] ] "source-value" [ [ 0.0182071 0.00139191 0.0164222 ] [ 1.32892 1.32964 1.49498 ] [ -0.00509802 2.67752 2.7579 ] [ 1.15566 4.0451 4.18086 ] [ 2.64397 0.106198 2.73506 ] [ 4.03699 1.34406 4.11378 ] [ 2.695 2.72586 0.109097 ] [ 4.00933 4.13019 1.43696 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.815837687309817e-18 "source-value" -36.299604 } }