Update Ta example

potentials/Ta_param.pod

@@ -1,4 +1,3 @@
-# DATE: 2022-11-30 UNITS: metal CONTRIBUTOR: Ngoc Cuong Nguyen, exapde@gmail.com CITATION:  https://arxiv.org/abs/2209.02362
 # chemical element symbols
 species Ta
 
@@ -11,28 +10,37 @@ rin 1.0
 # outer cut-off radius
 rcut 5.0
 
-# polynomial degrees for radial basis functions
-bessel_polynomial_degree 3
-inverse_polynomial_degree 6
+# use only for enviroment-adaptive potentials
+number_of_environment_clusters 1
 
-# one-body potential
-onebody 1
+# principal_components of local descriptors
+number_of_principal_components 2
+
+# polynomial degrees for radial basis functions
+bessel_polynomial_degree 4
+inverse_polynomial_degree 8
 
 # two-body linear POD potential
 twobody_number_radial_basis_functions 6
 
 # three-body linear POD potential
 threebody_number_radial_basis_functions 5
-threebody_number_angular_basis_functions 5
+threebody_angular_degree 4
 
-# four-body linear SNAP potential
-fourbody_snap_twojmax 0 
+# four-body linear POD potential
+fourbody_number_radial_basis_functions 4
+fourbody_angular_degree 3
 
-# quadratic POD potential
-quadratic_pod_potential 0
+# five-body linear POD potential
+fivebody_number_radial_basis_functions 2
+fivebody_angular_degree 0
+
+# six-body linear POD potential
+sixbody_number_radial_basis_functions 0
+sixbody_angular_degree 0
+
+# seven-body linear POD potential
+sevenbody_number_radial_basis_functions 0
+sevenbody_angular_degree 0
 
-# Add the following basename to the name of output files
-basename_for_output_files Ta
 
-# number of digits after the decimal point
-precision_for_pod_coefficients 5