{ "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" [ 5.42631 0 0 ] "si-unit" "m" "si-value" [ 5.42631e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0419811 5.40206 0 ] "si-unit" "m" "si-value" [ -4.19811e-12 5.40206e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.291495 -0.184222 5.7849 ] "si-unit" "m" "si-value" [ -2.91495e-11 -1.84222e-11 5.7849e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.101951 0.0451697 -0.178669 ] [ 1.35762 1.34832 0.905447 ] [ 0.453616 2.71025 3.0057 ] [ 1.36179 4.05856 4.06079 ] [ 2.63302 -0.145655 3.08939 ] [ 4.07266 1.35506 3.53695 ] [ 2.85903 2.69843 0.171649 ] [ 4.20927 3.69056 1.74197 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.01951e-11 4.51697e-12 -1.78669e-11 ] [ 1.35762e-10 1.34832e-10 9.05447e-11 ] [ 4.53616e-11 2.71025e-10 3.0057e-10 ] [ 1.36179e-10 4.05856e-10 4.06079e-10 ] [ 2.63302e-10 -1.45655e-11 3.08939e-10 ] [ 4.07266e-10 1.35506e-10 3.53695e-10 ] [ 2.85903e-10 2.69843e-10 1.71649e-11 ] [ 4.20927e-10 3.69056e-10 1.74197e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.0303479 -4.872059 -5.6213898 ] [ 1.850596 0.7119878 8.9481888 ] [ -5.6276973 -10.397276 -8.6895749 ] [ -1.5722307 0.8759236 16.2509608 ] [ 3.7652161 3.8999438 -10.44638 ] [ 4.0333496 2.6951834 4.3141559 ] [ 1.9619432 3.77902 -4.8847851 ] [ -0.380829 3.3072764 0.1288243 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.457329179070375e-09 -7.805899024958228e-09 -9.006459313963588e-09 ] [ 2.964981645745997e-09 1.140730207454826e-09 1.433657889386441e-08 ] [ -9.016565042999284e-09 -1.665827252720494e-08 -1.39222337494705e-08 ] [ -2.518991270044019e-09 1.403384313526971e-09 2.603690945929727e-08 ] [ 6.032541207679755e-09 6.248398778793911e-09 -1.67369458079927e-08 ] [ 6.462138432633033e-09 4.318159832248255e-09 6.912039721466384e-09 ] [ 3.143379526377539e-09 6.054657493535616e-09 -7.82628848485219e-09 ] [ -6.101553203226432e-10 5.29884092660359e-09 2.063992816509255e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -27.432888 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.395233179462487e-18 } }