{ "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" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.659108 -5.5553625 13.0030975 ] [ -10.0668879 11.4297582 -5.5378961 ] [ 17.2769017 -9.2159326 0.24004 ] [ 18.6341619 20.3765736 -7.2833772 ] [ -11.8365626 -4.6649841 -24.4267426 ] [ -8.4979414 -17.1888885 13.9108154 ] [ 5.1494364 4.818836 10.094063 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.707777363618225e-08 -8.900671917569041e-09 2.083325881248293e-08 ] [ -1.612893243759441e-08 1.831249136943709e-08 -8.8726876598395e-09 ] [ 2.768064798359978e-08 -1.476555175058856e-08 3.84586476056832e-10 ] [ 2.985521854438211e-08 3.264686983393049e-08 -1.166925667030777e-08 ] [ -1.896426386835567e-08 -7.47412846142373e-09 -3.913595591601941e-08 ] [ -1.361520303600842e-08 -2.753963529223798e-08 2.22875832101446e-08 ] [ 8.250306610376517e-09 7.72062637866939e-09 1.617247174748231e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 7.6811724 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.230659483961423e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6013717 1.6276908 5.4441172 ] [ 3.086239 3.7064565 1.5643378 ] [ 5.3439348 1.2443546 3.0543981 ] [ 4.830549 3.5499181 3.1538345 ] [ 1.9458675 1.640628 1.7599821 ] [ 3.1390231 0.4856594 3.4440387 ] [ 3.7417428 3.6935195 5.2484696 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6013717e-10 1.6276908e-10 5.4441172e-10 ] [ 3.086239e-10 3.7064565e-10 1.5643378e-10 ] [ 5.3439348e-10 1.2443546e-10 3.0543981e-10 ] [ 4.830549e-10 3.5499181e-10 3.1538345e-10 ] [ 1.9458675e-10 1.640628e-10 1.7599821e-10 ] [ 3.1390231e-10 4.856594e-11 3.4440387e-10 ] [ 3.7417428e-10 3.6935195e-10 5.2484696e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.8e-06 1.6e-06 5.5e-06 ] [ 9.7e-06 -6.7e-06 -1.4e-06 ] [ -2.9e-06 3e-06 -1.59e-05 ] [ -4e-06 7.3e-06 -2.2e-06 ] [ 4.9e-06 1e-06 9e-07 ] [ -1e-07 -6e-07 7.8e-06 ] [ 1e-07 -5.5e-06 5.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.249697764224e-14 2.56348259328e-15 8.8119714144e-15 ] [ 1.554111322176e-14 -1.073458335936e-14 -2.24304726912e-15 ] [ -4.646312200320001e-15 4.8065298624e-15 -2.547460827072e-14 ] [ -6.4087064832e-15 1.169588933184e-14 -3.52478856576e-15 ] [ 7.850665441919999e-15 1.6021766208e-15 1.44195895872e-15 ] [ -1.6021766208e-16 -9.6130597248e-16 1.249697764224e-14 ] [ 1.6021766208e-16 -8.8119714144e-15 8.491536090240001e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.037353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.889902527771674e-18 } }