XMVB 2.0: A new version of Xiamen valence bond program

Nonorthogonal orbital based N-body reduced density matrices and their applications to valence bond theory. IV. The automatic implementation of the Hessian based VBSCF method

(2014) Xun Chen et al.   JOURNAL OF CHEMICAL PHYSICS

Nonorthogonal orbital based n-body reduced density matrices and their applications to valence bond theory. III. Second-order perturbation theory using valence bond self-consistent field function as reference

(2014) Zhenhua Chen et al.   JOURNAL OF CHEMICAL PHYSICS

Nonorthogonal orbital based N-body reduced density matrices and their applications to valence bond theory. I. Hamiltonian matrix elements between internally contracted excited valence bond wave functions

(2013) Zhenhua Chen et al.   JOURNAL OF CHEMICAL PHYSICS

Nonorthogonal orbital based N-body reduced density matrices and their applications to valence bond theory. II. An efficient algorithm for matrix elements and analytical energy gradients in VBSCF method

(2013) Zhenhua Chen et al.   JOURNAL OF CHEMICAL PHYSICS

DFVB: A Density-Functional-Based Valence Bond Method

(2012) Fuming Ying et al.   Journal of Chemical Theory and Computation

An efficient algorithm for complete active space valence bond self-consistent field calculation

(2012) Jinshuai Song et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

VBEFP: A Valence Bond Approach That Incorporates Effective Fragment Potential Method

(2012) Fuming Ying et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Classical Valence Bond Approach by Modern Methods

(2011) Wei Wu et al.   CHEMICAL REVIEWS

Valence Bond Perturbation Theory. A Valence Bond Method That Incorporates Perturbation Theory†

(2009) Zhenhua Chen et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Critically Evaluated Thermochemical Properties of Polycyclic Aromatic Hydrocarbons

(2008) María Victoria Roux et al.   JOURNAL OF PHYSICAL AND CHEMICAL REFERENCE DATA