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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	22-Mar-2023	/ini_data_source/CuxO/adO/111 POSCAR_2_1	Lian, Zan	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex	Geometry optimization	DFT	-	-181.86692369; eV
	22-Mar-2023	/ini_data_source/CuxO/adO/111 POSCAR_1_4	Lian, Zan	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex	Geometry optimization	DFT	-	-187.58632034; eV
	22-Mar-2023	/ini_data_source/CuxO/adO/111 POSCAR_2_2	Lian, Zan	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex	Geometry optimization	DFT	-	-180.41650523; eV
	22-Mar-2023	/ini_data_source/CuxO/adO/110 POSCAR_3_3	Lian, Zan	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex	Geometry optimization	DFT	-	-115.90490936; eV
	7-Nov-2023	/NNP_application/annealing_convergence_test/annealing_rate/08 8ns	Lian, Zan	LAMMPS; 29 Sep 2021 - Update 3	Molecular Dynamics	-	-	-
	22-Mar-2023	/ini_data_source/CuxO/adO/110 POSCAR_1_5	Lian, Zan	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex	Geometry optimization	DFT	-	-128.93764041; eV
	22-Mar-2023	/ini_data_source/CuxO/adO/110 POSCAR_2_1	Lian, Zan	vasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex	Geometry optimization	DFT	-	-122.39932474; eV
	8-Nov-2023	/NNP_application/Odiffusion/Cu_shell/remove_different_layers/14layers 4	Lian, Zan	LAMMPS; 29 Sep 2021 - Update 3	Molecular Dynamics	-	-	-
	7-Nov-2023	/NNP_application/annealing_convergence_test/annealing_rate/13 0_1ns	Lian, Zan	LAMMPS; 29 Sep 2021 - Update 3	Molecular Dynamics	-	-	-
	7-Nov-2023	/NNP_application/annealing_convergence_test/annealing_rate/13 0_01ns	Lian, Zan	LAMMPS; 29 Sep 2021 - Update 3	Molecular Dynamics	-	-	-

Results 1711-1720 of 6322 (Search time: 0.002 seconds).