{ "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" [ 5.54692 0 0 ] "si-unit" "m" "si-value" [ 5.54692e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.123956 5.52099 0 ] "si-unit" "m" "si-value" [ 1.23956e-11 5.520990000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.202669 -0.109883 5.46638 ] "si-unit" "m" "si-value" [ 2.02669e-11 -1.09883e-11 5.466380000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.000314992 -0.0047744 0.0104344 ] [ 1.40487 1.33719 1.19876 ] [ 0.131099 2.68123 2.80213 ] [ 1.67848 4.08836 4.2255 ] [ 2.84099 -0.0865799 2.6392 ] [ 4.04763 1.27038 4.03721 ] [ 2.8307 2.64898 -0.0339665 ] [ 4.22323 4.11032 1.34741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.14992e-14 -4.7744e-13 1.04344e-12 ] [ 1.40487e-10 1.33719e-10 1.19876e-10 ] [ 1.31099e-11 2.68123e-10 2.80213e-10 ] [ 1.67848e-10 4.08836e-10 4.225500000000001e-10 ] [ 2.84099e-10 -8.65799e-12 2.639200000000001e-10 ] [ 4.04763e-10 1.27038e-10 4.03721e-10 ] [ 2.8307e-10 2.64898e-10 -3.39665e-12 ] [ 4.22323e-10 4.11032e-10 1.34741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.8477765 -3.3503143 3.28284 ] [ -2.3116254 2.752484 -4.0830401 ] [ 1.7990839 -3.6744364 -2.7046937 ] [ 1.5226549 1.4438719 5.3370767 ] [ 5.5258884 0.7199862 4.3460417 ] [ -3.3450661 -5.0540155 -7.1121537 ] [ -7.3180297 3.2835761 3.7632534 ] [ -1.7206824 3.8788479 -2.8293243 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.369170791963652e-09 -5.367795243791917e-09 5.259689497827073e-09 ] [ -3.703632171927449e-09 4.409965513926067e-09 -6.541751390008894e-09 ] [ 2.882450163437685e-09 -5.887096094696518e-09 -4.33339701256505e-09 ] [ 2.439562082326562e-09 2.313337801610076e-09 8.550939512156416e-09 ] [ 8.85344920362992e-09 1.153545056938633e-09 6.963126404761887e-09 ] [ -5.359386700450635e-09 -8.097425475260822e-09 -1.139492638167622e-08 ] [ -1.172477609566004e-08 5.260868860037643e-09 6.029396615626111e-09 ] [ -2.756837113102034e-09 6.214599421019177e-09 -4.533077246121326e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.225924 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.279244284207762e-18 } }