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What is the meaning of caspt2. Phrases containing caspt2
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What is the meaning of caspt2. Phrases containing caspt2
See meanings and uses of caspt2!caspt2
caspt2
caspt2
vibrational energies. MOLCAS also contains second order perturbation theory codes CASPT2 and RASPT2. MOLCAS code has been created at the late 1980s by the group
recovered with good accuracy by means of perturbative evaluations, such as CASPT2 and NEVPT. CASSCF Multi-configurational self-consistent field (MCSCF) v
perturbing (unimportant) determinants. Examples for those combinations are CASPT2 and SORCI. Explicitly correlated wavefunction (R12 method) This approach
multi-reference perturbation theories like complete active space perturbation theory (CASPT2). These methods can deal with extremely complex chemical situations and
CIS/semiempirical FSSH Newton-X MRCI, MR-AQCC, MCSCF, ADC(2), CC2, CIS, LR-TDDFT, XMS-CASPT2,a TD-DFTB,a QM/MM, analytical PES, user-defined PES FSSH (IC and ISCa) Pyxaid
Later Actinocenes Multiconfigurational? All-Electron Spin−Orbit Coupled CASPT2 Calculations on An(η8-C8H8)2(An = Th, U, Pu, Cm)". The Journal of Physical
uniquely, so many methods, such as complete active space perturbation theory (CASPT2), and Multi-Configuration Quasi-Degenerate Perturbation Theory (MCQDPT)
"For the development of important new theoretical methods, including the CASPT2 method, and for outstanding chemical applications to the excited electronic
perturbation theory: complete active-space second-order perturbation theory (CASPT2) with the four-component Dirac Hamiltonian". Radiation Induced Molecular
Later Actinocenes Multiconfigurational? All-Electron Spin−Orbit Coupled CASPT2 Calculations on An(η8-C8H8)2(An = Th, U, Pu, Cm)". The Journal of Physical
caspt2
Astrological/horoscope meaning of caspt2. caspt2 means: undefined
caspt2
C: Meaning of C in the acronym caspt2 means: C is a letter opened at one end. It exemplies openness, a welcoming attitude and the desire to share. This means healthy behaviours, confidence towards the outside world, positive thinking, striking, scholarstic abilities shown by an open-mindedness, lively and gregarious and triumphant. C curves aaway from the left to indicate prudence, nervousness in unfamiliar territory, tense and anxious behaviours when faced with the unknown.
A: Meaning of A in the acronym caspt2 means: The letter A has two bars connected at a pointed edge and a cross bar holding them together. From an open end to a pointed edge signifies that all energies are trained to a point to achieve the most singularly important goal. The cross bar shows caution. Failure is avoided by stringing all required resources together. A also looks like a Pyramid with the peak as the apex of the Pyramid. Pyramids are iconic. A therefore symbolizes prominence and a desire to be recognized for ones achievements. The cross bar also represents a rung in ladder. To get to the top, one has to first step on the rung. It also means originality, a strong will power and an enterprising ability. The upper-case version consists of the two slanting sides of a triangle, crossed in the middle by a horizontal bar. It shows aspiration, the dominance to be successful, positive attitude, an optimistic world view and egotism.
S: Meaning of S in the acronym caspt2 means: S is a single strand that goes forward and backwards. It shows a willingness to explore. Friendliness, perceptiveness and accommodating are all S qualities. The ends pointing forward and backwards shows a conflicting nature with itself and a degree of puzzlement.
P: Meaning of P in the acronym caspt2 means: P has a heavy top standing on just a point to show it's strenght. It means strong, the ability tp perceive weakness and opportunities easily and clear-sightedness. By standing on its own, it shows self-centeredness, a thriving attitude and rigorousness. P also shows disconnection, strong will to go even alone and impartiality.
T: Meaning of T in the acronym caspt2 means: T is a vertical strand crossed at the top by a horizontal strand. With the top strand balanced in the middle by the vertical strand, T shows balance and stability in its ways. It is also forgoing and spiritual. With the top strand projected up by the bottom strand, T is highly ambitious, but also kind to others as it can let others rest on its horizontal top. This makes T selfless, cooperative, womanly and dutiful. It also displays a high degree of generosity and liberalism.
2: Meaning of 2 in the acronym caspt2 means: undefined
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