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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	28-Aug-2025	/Oxygen-vacancies/In(OH)3-MO2-slabs/In(OH)3-HfO2/Subsurface In(OH)₃-m-HfO₂-vac-s6	Ritopecki, Milica	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Geometry optimization	DFT	-	-506.59428657; eV
	28-Aug-2025	/Oxygen-vacancies/In(OH)3-MO2-slabs/In(OH)3-ZrO2/Adatom In(OH)₃-m-ZrO₂-vac-s2	Ritopecki, Milica	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Geometry optimization	DFT	-	-483.17580912; eV
	28-Aug-2025	/Reaction-paths/Incorporated-In/In@t-ZrO2 In@t-ZrO₂-i06c	Ritopecki, Milica	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Geometry optimization	DFT	-	-471.04486443; eV
	28-Aug-2025	/Reaction-paths/Incorporated-In/In@m-ZrO2 In@m-ZrO₂-i07a_1	Ritopecki, Milica	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Geometry optimization	DFT	-	-457.92568651; eV
	28-Aug-2025	/Reaction-paths/Incorporated-In/In@m-ZrO2 In@m-ZrO₂-i04b	Ritopecki, Milica	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Geometry optimization	DFT	-	-463.71488287; eV
	28-Aug-2025	/Reaction-paths/Incorporated-In/In@m-ZrO2 In@m-ZrO₂-i05	Ritopecki, Milica	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Geometry optimization	DFT	-	-471.96707569; eV
	28-Aug-2025	/In-models/Slabs-In-adatom-adsorption/ZrO2 In-t-ZrO₂-s4	Ritopecki, Milica	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Geometry optimization	DFT	-	-453.64058793; eV
	26-Nov-2024	/fe_n3c1_o2/fe_n3c1_4/fe_n3c1_4_fs/fe_n3c1_4_fs_N1/rel_331 rel_331	Minotaki, Maria	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Geometry optimization	DFT	-	-663.12063225; eV
	26-Nov-2024	/fe_n3c1_o2/fe_n3c1_4/fe_n3c1_4_ho2/fe_n3c1_4_ho2_N5/rel_331 rel_331	Minotaki, Maria	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Geometry optimization	DFT	-	-661.17028208; eV
	26-Nov-2024	/fe_n3c1_o2/fe_n3c1_3/fe_n3c1_3_oo/fe_n3c1_3_oo_N3/rel_331 rel_331	Minotaki, Maria	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex	Geometry optimization	DFT	-	-661.24118779; eV

Results 92591-92600 of 93762 (Search time: 0.055 seconds).