{ "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" [ 5.52526 0 0 ] "si-unit" "m" "si-value" [ 5.52526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.163004 5.51064 0 ] "si-unit" "m" "si-value" [ 1.63004e-11 5.510640000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0929221 -0.0543858 5.47616 ] "si-unit" "m" "si-value" [ 9.29221e-12 -5.43858e-12 5.47616e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0515746 -0.0381365 -0.00729456 ] [ 1.44408 1.32704 1.45073 ] [ 0.0791767 2.70101 2.71983 ] [ 1.48556 4.06547 4.00394 ] [ 2.80111 0.011527 2.65388 ] [ 4.15958 1.27318 3.97985 ] [ 2.73428 2.80936 0.100172 ] [ 4.13679 4.02299 1.21489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.15746e-12 -3.81365e-12 -7.29456e-13 ] [ 1.44408e-10 1.32704e-10 1.45073e-10 ] [ 7.917670000000001e-12 2.70101e-10 2.71983e-10 ] [ 1.48556e-10 4.06547e-10 4.00394e-10 ] [ 2.80111e-10 1.1527e-12 2.65388e-10 ] [ 4.15958e-10 1.27318e-10 3.97985e-10 ] [ 2.73428e-10 2.80936e-10 1.00172e-11 ] [ 4.136790000000001e-10 4.02299e-10 1.21489e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5131481 0.6803298 -0.15960669999999996 ] [ -1.1839397 1.356511 -2.6090925999999994 ] [ -2.0716757 0.0637074 -0.9014577999999998 ] [ 2.5752697 0.4878093 0.5349959999999999 ] [ -0.8028181 -4.0949747 0.5767567999999998 ] [ 1.7566931 1.9389635 3.595538799999999 ] [ -3.5729944 -4.7462673 -5.680238899999999 ] [ 5.8126131 4.3139211 4.643104599999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.026507130427941e-09 1.09000849999354e-09 -2.557181232630393e-10 ] [ -1.896880507776966e-09 2.173370210058029e-09 -4.180227165222285e-09 ] [ -3.319190372419475e-09 1.020705068519539e-10 -1.444294611797802e-09 ] [ 4.12603690559463e-09 7.815566558688135e-10 8.571580834215167e-10 ] [ -1.286256390575077e-09 -6.560872727107494e-09 9.240662608474212e-10 ] [ 2.814532614740677e-09 3.106561988284541e-09 5.760688204539285e-09 ] [ -5.724568093929324e-09 -7.60435850412754e-09 -9.100745966138708e-09 ] [ 9.312832814575812e-09 6.911663530395819e-09 7.439073638048934e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.164359 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.633951387521806e-18 } }