diff --git a/source/Tutorials/DP-GEN/learnDoc/DP-GEN_handson.md b/source/Tutorials/DP-GEN/learnDoc/DP-GEN_handson.md index eb49bae..16f9a37 100644 --- a/source/Tutorials/DP-GEN/learnDoc/DP-GEN_handson.md +++ b/source/Tutorials/DP-GEN/learnDoc/DP-GEN_handson.md @@ -114,7 +114,7 @@ We can perform the run process as we expect by specifying the keywords in param. - System and data: used to specify the atom types, initial data, etc. - Training: mainly used to specify tasks in the training step; -- Exploration: mainly used to specify tasks in the labeling step; +- Exploration: mainly used to specify tasks in the Exploration step; - Labeling: mainly used to specify tasks in the labeling step. Here we introduce the main keywords in param.json, taking a gas-phase methane molecule as an example. @@ -150,9 +150,7 @@ Description of example: The system related keys specify the basic information about the system. "type_map" gives the atom types, i.e. "H" and "C". "mass_map" gives the standard atom weights, i.e. "1" and "12". -The data related keys specify the init data for traning initial DP models and structures used for model_devi calculations. "init_data_prefix" and "init_data_sys" specify the location of the init data. "sys_configs_prefix" and "sys_configs" specify the location of the structures. Here, the init data is provided at "...... /init/CH4.POSCAR.01x01x01/02.md/sys-0004-0001/deepmd". These structures are divided into two groups and provided at "....../init/CH4.POSCAR.01x01x01/01.scale_pert/sys-0004-0001/scale- -1.000/00000*/POSCAR" and "....../init/CH4.POSCAR.01x01x01/01.scale_pert/sys-0004-0001/scale- -1.000/00001*/POSCAR". +The data related keys specify the init data for training initial DP models and structures used for model_devi calculations. "init_data_prefix" and "init_data_sys" specify the location of the init data. "sys_configs_prefix" and "sys_configs" specify the location of the structures. Here, the init data is provided at "...... /init/CH4.POSCAR.01x01x01/02.md/sys-0004-0001/deepmd". These structures are divided into two groups and provided at "....../init/CH4.POSCAR.01x01x01/01.scale_pert/sys-0004-0001/scale-1.000/00000*/POSCAR" and "....../init/CH4.POSCAR.01x01x01/01.scale_pert/sys-0004-0001/scale-1.000/00001*/POSCAR". **Training** @@ -331,7 +329,7 @@ Description of keywords: |     "context_type"| str| The connection used to remote machine.| |     "local_root" | str| The dir where the tasks and relating files locate.| |     "remote_root" | str| The dir where the tasks are executed on the remote machine.| -| "machine"| dict| The definition of resources.| +| "resource"| dict| The definition of resources.| |     "number_node" | int| The number of node need for each job.| |     "cpu_per_node"| int| cpu numbers of each node assigned to each job.| |     "gpu_per_node"| int| gpu numbers of each node assigned to each job.|