--amend

Basis/ContractedShellPair.mli

@@ -2,12 +2,12 @@
 
 A contracted shell pair is a product of two {!ContractedShell.t}:
 
-{% \\[
+{% \begin{align*}
 \varphi_{ab}(r) & = \chi_a(r) \times \chi_b(r) \\
-                & = P_a \sum_{i=1}^m_a \mathcal{N}_i^a f_i[P_a] d_i^a \exp \left( -\alpha_i^a |r-R_a|^2 \right) \times \\
+& = P_a \sum_{i=1}^{m_a} \mathcal{N}_i^a f_i[P_a] d_i^a \exp \left( -\alpha_i^a |r-R_a|^2 \right) \times 
-                &   P_b \sum_{j=1}^m_b \mathcal{N}_j^b f_j[P_b] d_j^b \exp \left( -\alpha_j^b |r-R_b|^2 \right)
+    P_b \sum_{j=1}^{m_b} \mathcal{N}_j^b f_j[P_b] d_j^b \exp \left( -\alpha_j^b |r-R_b|^2 \right) \\
-                & = P_a P_b \sum_{i=1}^m_a \sum_{j=1}^m_b \mathcal{N}_i^a \mathcal{N}_j^b f_i[P_a] f_j[P_b] d_i^a d_j^b \exp \left( -\alpha_i^a |r-R_a|^2 \right -\alpha_j^b |r-R_b|^2 \right)
+& = P_a P_b \sum_{i=1}^{m_a} \sum_{j=1}^{m_b} \left( \mathcal{N}_i^a \mathcal{N}_j^b \right) \left( f_i[P_a] f_j[P_b] \right) \left( d_i^a d_j^b \right) \exp \left( -\alpha_i^a |r-R_a|^2 -\alpha_j^b |r-R_b|^2 \right) \\
-   \\]
+\end{align*} %}
 
 *)
 
@@ -28,12 +28,12 @@ val of_basis : ContractedShell.t array -> t array array
 (** Creates all possible contracted shell pairs from the basis set. *)
 
 val shell_a : t -> ContractedShell.t
-(** Returns the first {%ContractedShell.t}  {% $\chi_a$ %} which was used to
+(** Returns the first {!ContractedShell.t}  {% $\chi_a$ %} which was used to
     build the contracted shell pair.
 *)
 
 val shell_b : t -> ContractedShell.t
-(** Returns the second {%ContractedShell.t} {% $\chi_b$ %} which was used to
+(** Returns the second {!ContractedShell.t} {% $\chi_b$ %} which was used to
     build the contracted shell pair.
 *)