{ "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" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2177311 -6.6150271 2.9120237 ] [ 1.6731581 0.2641276 -1.9578681 ] [ -1.5798965 0.7051054 3.8954671 ] [ 4.4712185 7.0428937 0.3645007 ] [ 0.3806122 0.4433874 -0.413194 ] [ -2.257859 1.9089271 -1.880607 ] [ -0.4695021 -3.7494141 -2.9203223 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.553196919641067e-09 -1.059844176557842e-08 4.665576291355513e-09 ] [ 2.680694790722149e-09 4.231790656280141e-10 -3.136850496430117e-09 ] [ -2.531273235583747e-09 1.129703387079832e-09 6.241226314715576e-09 ] [ 7.163681747188445e-09 1.128395962891961e-08 5.839944998052346e-10 ] [ 6.098079684312538e-10 7.103849262372979e-10 -6.620097666548353e-10 ] [ -3.617488902862867e-09 3.058438370431544e-09 -3.013064568312825e-09 ] [ -7.522252880365036e-10 -6.007223612717874e-09 -4.678872114260884e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.519326 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.447776101257358e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.925474 0.4675385 2.3998214 ] [ 1.5637241 2.3314432 3.1040879 ] [ 1.4720544 2.8143281 5.4578232 ] [ 3.6525219 2.7321403 1.963557 ] [ 2.7882677 0.9248999 4.7655066 ] [ 4.8380828 1.3703726 3.572084 ] [ 3.5392231 3.2639644 4.3148949 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.925474e-10 4.675385000000001e-11 2.3998214e-10 ] [ 1.5637241e-10 2.3314432e-10 3.1040879e-10 ] [ 1.4720544e-10 2.8143281e-10 5.4578232e-10 ] [ 3.6525219e-10 2.7321403e-10 1.963557e-10 ] [ 2.7882677e-10 9.248999e-11 4.7655066e-10 ] [ 4.8380828e-10 1.3703726e-10 3.572084e-10 ] [ 3.5392231e-10 3.2639644e-10 4.3148949e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9e-07 -6e-07 7.3e-06 ] [ 3.3e-06 4.5e-06 -4e-07 ] [ -6.6e-06 -2e-06 6.5e-06 ] [ 1.9e-06 3.5e-06 -5.2e-06 ] [ -4.8e-06 -5.4e-06 1.4e-06 ] [ 2.9e-06 1.8e-06 -2.6e-06 ] [ 2.6e-06 -1.8e-06 -7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.44195895872e-15 -9.6130597248e-16 1.169588933184e-14 ] [ 5.28718284864e-15 7.2097947936e-15 -6.408706483200001e-16 ] [ -1.057436569728e-14 -3.2043532416e-15 1.04141480352e-14 ] [ 3.04413557952e-15 5.6076181728e-15 -8.33131842816e-15 ] [ -7.69044777984e-15 -8.65175375232e-15 2.24304726912e-15 ] [ 4.646312200320001e-15 2.88391791744e-15 -4.16565921408e-15 ] [ 4.16565921408e-15 -2.88391791744e-15 -1.12152363456e-14 ] ] } "relaxed-potential-energy" { "source-value" -29.696935 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.757973496641725e-18 } }