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Testing of different treatments of the van der Waals contribution Schulz, Liljeroth, Seitsonen, Physical Review Materials 2019 CP2K inputs and final geometries Under construction!!! gr, 10-on-9, LDA, axc: Input / Final geometry gr, 10-on-9, PBE+D3, axc: Input / Final geometry gr, 10-on-9, revPBE+D3, axc: Input / Final geometry gr, 10-on-9, vdW-DF, axc: Input / Final geometry gr, 10-on-9, vdW-DF-rB86, axc: Input / Final geometry gr, 10-on-9, vdW-DF2, axc: Input / Final geometry gr, 10-on-9, vdW-DF2-optB88, axc: Input / Final geometry gr, 10-on-9, vdW-DF2-C09, axc: Input / Final geometry gr, 10-on-9, vdW-DF2-rB86 (VWN instead of LDA-PW), axc: Input / Final geometry gr, 10-on-9, vdW-DF2-rB86 (VWN instead of LDA-PW), axc, thick: Input / Final geometry gr, 10-on-9, BEEF-DF2, axc: Input / Final geometry gr, 10-on-9, rVV10, axc: Input / Final geometry gr, 10-on-9, PBE+rVV10, axc: Input / Final geometry gr, 10-on-9, LDA, aexp: Input / Final geometry gr, 10-on-9, PBE+D3, aexp: Input / Final geometry gr, 10-on-9, revPBE+D3, aexp: Input / Final geometry gr, 10-on-9, vdW-DF, aexp: Input / Final geometry gr, 10-on-9, vdW-DF-rB86, aexp: Input / Final geometry gr, 10-on-9, vdW-DF2, aexp: Input / Final geometry gr, 10-on-9, vdW-DF2-optB88, aexp: Input / Final geometry gr, 10-on-9, vdW-DF2-C09, aexp: Input / Final geometry gr, 10-on-9, vdW-DF2-rB86 (VWN instead of LDA-PW), aexp: Input / Final geometry gr, 10-on-9, BEEF-DF2, aexp: Input / Final geometry gr, 10-on-9, rVV10, aexp: Input / Final geometry gr, 10-on-9, PBE+rVV10, aexp: Input / Final geometry h-BN, 12-on-11, PBE+D3, ah-BN: Input / Final geometry h-BN, 12-on-11, PBE+D3, ah-BN: Input / Final geometry h-BN, 12-on-11, revPBE+D3, ah-BN: Input / Final geometry h-BN, 12-on-11, vdW-DF, ah-BN: Input / Final geometry h-BN, 12-on-11, vdW-DF, ah-BN: Input / Final geometry h-BN, 12-on-11, vdW-DF-optB88, ah-BN: Input / Final geometry h-BN, 12-on-11, vdW-DF2-C09, ah-BN: Input / Final geometry h-BN, 12-on-11, BEEF-DF2, ah-BN: Input / Final geometry h-BN, 12-on-11, rVV10, ah-BN: Input / Final geometry h-BN, 12-on-11, LDA, axc: Input / Final geometry h-BN, 12-on-11, PBE+D2, axc: Input / Final geometry h-BN, 12-on-11, PBE+D2, axc: Input / Final geometry h-BN, 12-on-11, PBE+D3, axc: Input / Final geometry h-BN, 12-on-11, PBE+D3, axc: Input / Final geometry h-BN, 12-on-11, revPBE+D3, axc: Input / Final geometry h-BN, 12-on-11, revPBE+D3, axc: Input / Final geometry h-BN, 12-on-11, revPBE+D3, axc: Input / Final geometry h-BN, 12-on-11, vdW-DF, axc: Input / Final geometry h-BN, 12-on-11, vdW-DF-rB86, axc: Input / Final geometry h-BN, 12-on-11, vdW-DF-optB88, axc: Input / Final geometry h-BN, 12-on-11, vdW-DF-optB88, axc: Input / Final geometry h-BN, 12-on-11, vdW-DF2, axc: Input / Final geometry h-BN, 12-on-11, vdW-DF2-C09, axc: Input / Final geometry h-BN, 12-on-11, vdW-DF2-rB86, axc: Input / Final geometry h-BN, 12-on-11, vdW-DF2-rB86, axc, laterally shifted: Input / Final geometry h-BN, 12-on-11, vdW-DF2-rB86, axc, laterally shifted 2: Input / Final geometry h-BN, 12-on-11, vdW-DF2-rB86, axc, thick: h-BN, 12-on-11, vdW-DF2-rB86, axc, thick, laterally shifted: Input / Final geometry h-BN, 12-on-11, BEEF-DF2, axc: Input / Final geometry h-BN, 12-on-11, BEEF-DF2, axc: Input / Final geometry h-BN, 12-on-11, rVV10, axc: Input / Final geometry h-BN, 12-on-11, PBE+rVV10, axc: Input / Final geometry h-BN, 12-on-11, LDA, aexp: Input / Final geometry h-BN, 12-on-11, PBE+D2, aexp: Input / Final geometry h-BN, 12-on-11, PBE+D2, aexp: Input / Final geometry h-BN, 12-on-11, PBE+D3, aexp: Input / Final geometry h-BN, 12-on-11, PBE+D3, aexp: Input / Final geometry h-BN, 12-on-11, revPBE+D3, aexp: Input / Final geometry h-BN, 12-on-11, revPBE+D3, aexp: Input / Final geometry h-BN, 12-on-11, vdW-DF, aexp: Input / Final geometry h-BN, 12-on-11, vdW-DF-optB88, aexp: Input / Final geometry h-BN, 12-on-11, vdW-DF-rB86, aexp: Input / Final geometry h-BN, 12-on-11, vdW-DF2, aexp: Input / Final geometry h-BN, 12-on-11, vdW-DF2-C09, aexp: Input / Final geometry h-BN, 12-on-11, vdW-DF2-rB86, aexp: Input / Final geometry h-BN, 12-on-11, BEEF-DF2, aexp: Input / Final geometry h-BN, 12-on-11, rVV10, aexp: Input / Final geometry h-BN, 12-on-11, PBE+rVV10, aexp: Input / Final geometry h-BN, 13-on-12, PBE+D2, axc: Input / Final geometry h-BN, 13-on-12, PBE+D2, axc: Input / Final geometry h-BN, 13-on-12, vdW-DF, axc: Input / Final geometry h-BN, 13-on-12, vdW-DF, axc: Input / Final geometry h-BN, 13-on-12, vdW-DF, axc: Input / Final geometry h-BN, 13-on-12, vdW-DF2, axc: Input / Final geometry h-BN, 13-on-12, vdW-DF2, axc: Input / Final geometry h-BN, 13-on-12, vdW-DF2-rB86, axc: Input / Final geometry h-BN, 13-on-12, vdW-DF2-rB86, axc: Input / Final geometry h-BN, 13-on-12, vdW-DF2-rB86, axc: Input / Final geometry h-BN, 13-on-12, vdW-DF2-rB86, aexp: Input / Final geometry h-BN, 13-on-12, vdW-DF2-rB86, aexp: Input / Final geometry