【13018XEa145】VASP专题培训：低维材料DFT计算_58
课程目录：
10_5-1_ 结构性质文献案例.mp4 (128.51MB)
11_5-2_ 结构性质基本概念.mp4 (76.16MB)
12_5-3_ Graphene模型构建与结构优化.mp4 (560.71MB)
13_5-4_ B掺杂Graphene负载Ru模型构建.mp4 (484.88MB)
14_5-5_ Graphene纳米带模型构建与结构优化.mp4 (805.68MB)
15_5-6_ Silicene模型构建与结构优化.mp4 (100.03MB)
16_5-7_ H-Silicene模型构建与结构优化.mp4 (241.06MB)
17_5-8_ B掺杂Silicene模型构建与结构优化.mp4 (334.26MB)
18_5-9_ MoB模型构建与结构优化.mp4 (108.67MB)
19_5-10_ Graphene~Silicene异质结构模型.mp4 (541.16MB)
1_1-1_ Hatree-Fock理论.mp4 (144.28MB)
20_6-1_ 电子性质文献案例.mp4 (190.07MB)
21_6-2_ 电子性质基本概念.mp4 (18.31MB)
22_6-3_ 电场对Silicene能带结构的影响.mp4 (362.93MB)
23_6-4_ H-Silicene电荷密度分布.mp4 (292.77MB)
24_6-5_ H-Silicene电子态密度.mp4 (226.26MB)
25_6-6_ H-Silicene轨道分析.mp4 (450.51MB)
26_6-7_ H-Silicene能带结构.mp4 (135.06MB)
27_6-8_ Graphene纳米带自旋密度与电子态密度.mp4 (405.34MB)
28_6-9_ Graphene~Silicene异质结构差分电荷密度与结合能.mp4 (342.28MB)
29_7-2_ 电池性质基本概念.mp4 (175.62MB)
2_1-2_ 密度泛函理论.mp4 (141.36MB)
30_7-3_ B掺杂Silicene离子容量与电位.mp4 (680.09MB)
31_7-4_ B掺杂Silicene与离子相互作用.mp4 (172.37MB)
32_7-5_ B掺杂Silicene的离子扩散势垒与路径.mp4 (673.61MB)
33_7-6_ Graphene~Silicene异质结构与离子相互作用.mp4 (312.24MB)
34_7-7_ Graphene~Silicene异质结构的离子扩散势垒与路径.mp4 (77.82MB)
35_7-1_ 电池性质文献案例.mp4 (342.3MB)
36_8-1_ 吸附与催化性质文献案例.mp4 (621.4MB)
37_8-2_ B掺杂Graphene负载Ru吸附O.mp4 (147.59MB)
38_8-3_ B掺杂Graphene负载Ru吸附OH.mp4 (112.48MB)
39_8-4_ B掺杂Graphene负载Ru吸附OOH.mp4 (97.2MB)
3_1-3_ 计算方法.mp4 (195.94MB)
40_8-5_ B掺杂Graphene负载Ru催化OER.mp4 (176.94MB)
41_8-6_ Graphene纳米带吸附H.mp4 (135.77MB)
42_8-7_ Graphene纳米带吸附OH.mp4 (67.55MB)
43_8-8_ Graphene纳米带吸附O.mp4 (63.55MB)
44_8-9_ Graphene纳米带吸附OOH.mp4 (99.72MB)
45_8-10_ Graphene纳米带吸附OO.mp4 (102.06MB)
46_9-1_ Graphene纳米带催化OER自由能变化.mp4 (46.78MB)
47_9-2_ Graphene纳米带吸附H2O.mp4 (162.43MB)
48_9-3_ Graphene纳米带吸附H2O2.mp4 (170.32MB)
49_9-4_ MoB吸附CO2.mp4 (290.19MB)
4_2-1_ VASP运行流程.mp4 (178.19MB)
50_9-5_ MoB吸附COOH.mp4 (92.14MB)
51_9-6_ MoB吸附HCOO.mp4 (96.65MB)
52_9-7_ MoB吸附CO.mp4 (311.7MB)
53_9-8_ CO2在MoB表面加H生成COOH的过渡态.mp4 (183.22MB)
54_9-9_ 催化剂线性约束关系.mp4 (66.48MB)
55_9-10_ Graphene纳米带吸附CO及分解为C和O的势垒与路径.mp4 (622.23MB)
56_9-11_ Graphene纳米带吸附CO2及分解为CO和O的势垒与路径.mp4 (253.94MB)
57_10-1_ 环境变量配置.mp4 (64.14MB)
58_10-2_ 总结.mp4 (49.26MB)
5_2-2_ VASP输入输出文件.mp4 (478.44MB)
6_3-1_ 超算平台连接.mp4 (96.31MB)
7_3-2_ Linux操作系统命令.mp4 (202.48MB)
8_4-1_ 建模软件VESTA操作.mp4 (255.01MB)
9_4-2_ 绘图软件Gnuplot操作演示.mp4 (241.37MB)
