بدائل البحث:
algorithm python » algorithm within (توسيع البحث), algorithms within (توسيع البحث), algorithm both (توسيع البحث)
algorithm b » algorithm _ (توسيع البحث), algorithms _ (توسيع البحث)
algorithm 1 » algorithm _ (توسيع البحث), algorithms _ (توسيع البحث), algorithm 8217 (توسيع البحث)
1 function » _ function (توسيع البحث), a function (توسيع البحث)
algorithm python » algorithm within (توسيع البحث), algorithms within (توسيع البحث), algorithm both (توسيع البحث)
algorithm b » algorithm _ (توسيع البحث), algorithms _ (توسيع البحث)
algorithm 1 » algorithm _ (توسيع البحث), algorithms _ (توسيع البحث), algorithm 8217 (توسيع البحث)
1 function » _ function (توسيع البحث), a function (توسيع البحث)
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ADT: A Generalized Algorithm and Program for Beyond Born–Oppenheimer Equations of “<i>N</i>” Dimensional Sub-Hilbert Space
منشور في 2020"…It is noteworthy to mention that the nonadiabatic coupling terms (NACTs) often become singular (removable) at degenerate point(s) or along a seam in the nuclear configuration space (CS) and thereby, a unitary transformation is required to convert the kinetically coupled (adiabatic) Hamiltonian to a potentially (diabatic) one to avoid such singularity(ies). The “ADT” program can be efficiently used to (a) formulate analytic functional forms of differential equations for ADT angles and diabatic potential energy matrix and (b) solve the set of coupled differential equations numerically to evaluate ADT angles, residue due to singularity(ies), ADT matrices, and finally, diabatic potential energy surfaces (PESs). …"
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