{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.5147554 -2.6647946 -1.7520183 ] [ -0.3453858 -0.4787954 1.6703104 ] [ 3.4311237 2.8102324 -0.3786317 ] [ -1.3784805 2.5047595 1.874509 ] [ 3.3600569 -3.5985443 -5.8111912 ] [ 3.688383 2.6077084 3.8199577 ] [ -2.2409419 -1.180566 0.577064 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.043778887810532e-08 -4.269471642529376e-09 -2.807042782600402e-09 ] [ -5.533690584753971e-10 -7.671148023466835e-10 2.676132294407193e-09 ] [ 5.497266220503625e-09 4.502488687389741e-09 -6.066348626316978e-10 ] [ -2.208569247524637e-09 4.013067144689523e-09 3.003294520022705e-09 ] [ 5.383404654090474e-09 -5.765503593873885e-09 -9.310554756346418e-09 ] [ 5.909441059842822e-09 4.178009466765525e-09 6.12024696980838e-09 ] [ -3.590384750331565e-09 -1.891475260094844e-09 9.245584571225759e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.535235 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.129889705669899e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1675235 2.319571 2.6526229 ] [ 2.3418081 1.3662826 4.5595817 ] [ 2.6391963 4.1286267 1.9485492 ] [ 1.998025 3.8898462 4.4794968 ] [ 3.5978754 1.5862038 2.342786 ] [ 4.3443231 2.7443881 4.7176617 ] [ 4.9463167 3.6145175 2.5264227 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1675235e-10 2.319571e-10 2.6526229e-10 ] [ 2.3418081e-10 1.3662826e-10 4.5595817e-10 ] [ 2.6391963e-10 4.1286267e-10 1.9485492e-10 ] [ 1.998025e-10 3.8898462e-10 4.4794968e-10 ] [ 3.5978754e-10 1.5862038e-10 2.342786e-10 ] [ 4.344323100000001e-10 2.7443881e-10 4.7176617e-10 ] [ 4.9463167e-10 3.6145175e-10 2.5264227e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0001439 -1.82e-05 1.83e-05 ] [ -2.6e-05 1.18e-05 6.03e-05 ] [ -4.84e-05 7.26e-05 -8.03e-05 ] [ 0.0001091 -0.0001487 -7.86e-05 ] [ -0.0001373 8.17e-05 7.87e-05 ] [ -6.3e-05 -1.98e-05 -1.45e-05 ] [ 2.17e-05 2.05e-05 1.61e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.305532176326e-13 -2.915961473879999e-14 2.93198324022e-14 ] [ -4.165659248399999e-14 1.89056842812e-14 9.661125103019999e-14 ] [ -7.754534908559998e-14 1.163180236284e-13 -1.286547837102e-13 ] [ 1.747974707694e-13 -2.382436654758e-13 -1.259310834324e-13 ] [ -2.199788518482e-13 1.308978309978e-13 1.260913010958e-13 ] [ -1.00937127942e-13 -3.17230973532e-14 -2.3231561193e-14 ] [ 3.476723295779999e-14 3.2844620997e-14 2.579504380739999e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.095233 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.540046603538572e-18 } }