Occupation Numbers Of The Localized Orbitals Of S 0 Le And Ict States
Occupation numbers of the localized orbitals of S 0 , LE and ICT states ...
Occupation numbers of each level of orbitals for the initial and final ...
Occupation numbers of each level of orbitals for the initial and final ...
Occupation numbers of the σ g and σ u orbitals in H 2 as a function of ...
Upper panel: occupation numbers of the most relevant natural orbitals ...
The occupation number of different orbitals (proton and neutron) for ...
Occupation numbers of active orbitals for the ground state of ...
Occupation numbers of the active orbitals (HOMO − 3, HOMO − 2, HOMO − ...
Color online The occupation numbers of the first two natural orbitals ...
Largest occupation numbers of the natural orbitals for (a) the A ...
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Orbital occupation diagrams e and f show the or and T orbitals of PeAG ...
Color online The occupation numbers of the FCI natural orbitals that ...
Occupation numbers of active orbitals for the ground state of ...
The natural orbitals and the corresponding natural occupation number of ...
Variations of the occupation numbers for the eight active orbitals ...
Occupation numbers of (a) a-spin and (b) b-spin active orbitals ...
Occupation numbers of active orbitals for the ground state of Möbius ...
Occupation numbers of the active orbitals in the CASSCF(8,8)/AVTZ ...
Occupation numbers ns(E) (see Eq. (2)), for the even states of Ce at ...
Variations of the occupation numbers for the eight active orbitals ...
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The occupation numbers n m,α of the natural orbitals as a function of ...
The spin-up occupation numbers of p orbital of O and Br atoms under ...
Occupation numbers of the STO-3G FCI natural orbitals as a function of ...
Occupation numbers for bonding and antibonding orbitals of addimers on ...
| Spin natural orbitals (SNO) and their occupation numbers of main ...
Distribution of the occupation numbers of the natural orbitals for 1D ...
VS natural orbitals and occupation numbers for the mod-CPO (9e12o ...
Figure 1 from Softmax parameterization of the occupation numbers for ...
1 Occupation numbers as a function of orbital energy from the ...
The FCI natural orbital occupation numbers ͑ NOONs ͒ of the 15th– 18th ...
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The distribution of natural orbital occupation numbers from the ...
Active natural orbitals and their occupation numbers resulting from the ...
Changes in occupation number of the five Co 3d (blue) and Ir 5d ...
Active orbitals and their occupation numbers from the CAS(12,12 ...
(Color online) Mean occupation numbers ni of the harmonic-oscillator ...
(Color online) The occupation number (n i ) of localized d-orbitals for ...