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Date Name Thumbnail Size User Description Versions
12:45, 27 February 2025 Dft+d.png (file) 41 KB Csheldon Dipole-dipole interactions between atoms (black dots) and quadrupole-dipole interactions (in some cases) 1
12:45, 27 February 2025 Mbd.png (file) 44 KB Csheldon Dipole-dipole interactions between atoms (black dots) in many-body dispersions (includes additional 3-, 4-, N-body dipole interaction terms. 1
12:46, 27 February 2025 Non local dft.png (file) 59 KB Csheldon Non-local DFT interaction between pairwise dipole fluctuations in the density. 1
12:14, 28 February 2025 EELS bulk Si BSE TDHF Q2 py4vasp.png (file) 24 KB Pmelo   2
15:16, 28 February 2025 GaAs zincblende py4vasp 2SC.png (file) 247 KB Wolloch 2x2x2 Supercell of bulk zincblende GaAs. Created with py4vasp. 1
14:37, 5 March 2025 EELS bulk Si DFT py4vasp.png (file) 18 KB Pmelo   2
14:40, 5 March 2025 EELS bulk Si BSE TDHF Q1 py4vasp.png (file) 24 KB Pmelo   2
14:52, 5 March 2025 EELS bulk Si DFT result.png (file) 10 KB Pmelo   2
14:56, 5 March 2025 EELS bulk Si BSE TDHF Q1 result.png (file) 13 KB Pmelo   3
14:57, 5 March 2025 EELS bulk Si BSE TDHF Q2 result.png (file) 42 KB Pmelo   3
15:00, 27 March 2025 SrVO3 U omega acont.png (file) 66 KB Kaltakm Effectively screened Coulomb interaction (one-site) of SrVO3 evaluated in minimal Wannier basis using 3 t2g states centered on V. The real-frequency dependence has been obtained from 24 imaginary (compressed) Matsubara points evaluated using the euclidean GW implementation. 1
15:17, 27 March 2025 CRPA of SrVO3.zip (file) 262 KB Kaltakm updates related to vasp.6.5.2 2
16:11, 14 April 2025 Plane wave on grid.png (file) 61 KB Csheldon   4
07:38, 15 April 2025 Real to reciprocal space.png (file) 683 KB Csheldon   6
08:04, 16 April 2025 Second kpoint on grid cropped.png (file) 199 KB Csheldon Changed radii slightly so that symmetry is correct 8
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