標(biāo)題: Titlebook: Explicitly Correlated Wave Functions in Chemistry and Physics; Theory and Applicati Jacek Rychlewski Book 2003 Springer Science+Business Me [打印本頁(yè)] 作者: radionuclides 時(shí)間: 2025-3-21 18:09
書目名稱Explicitly Correlated Wave Functions in Chemistry and Physics影響因子(影響力)
書目名稱Explicitly Correlated Wave Functions in Chemistry and Physics影響因子(影響力)學(xué)科排名
書目名稱Explicitly Correlated Wave Functions in Chemistry and Physics網(wǎng)絡(luò)公開度
書目名稱Explicitly Correlated Wave Functions in Chemistry and Physics網(wǎng)絡(luò)公開度學(xué)科排名
書目名稱Explicitly Correlated Wave Functions in Chemistry and Physics被引頻次
書目名稱Explicitly Correlated Wave Functions in Chemistry and Physics被引頻次學(xué)科排名
書目名稱Explicitly Correlated Wave Functions in Chemistry and Physics年度引用
書目名稱Explicitly Correlated Wave Functions in Chemistry and Physics年度引用學(xué)科排名
書目名稱Explicitly Correlated Wave Functions in Chemistry and Physics讀者反饋
書目名稱Explicitly Correlated Wave Functions in Chemistry and Physics讀者反饋學(xué)科排名
作者: visceral-fat 時(shí)間: 2025-3-21 23:07
Progress in Theoretical Chemistry and Physicshttp://image.papertrans.cn/e/image/319364.jpg作者: 運(yùn)氣 時(shí)間: 2025-3-22 04:18
Michael Kleinaltenkamp,Marco Schm?hThe 1/.. singularity in the Hamiltonian describing a system of interacting electrons results in a cusp of the corresponding eigenfunctions. In the vicinity of .. = 0 the non-relativistic wavefunction is linear in .. [1].作者: Admire 時(shí)間: 2025-3-22 06:45 作者: 無(wú)法解釋 時(shí)間: 2025-3-22 11:52
Hylleraas-CI Approach to Diraccoulomb EquationThe 1/.. singularity in the Hamiltonian describing a system of interacting electrons results in a cusp of the corresponding eigenfunctions. In the vicinity of .. = 0 the non-relativistic wavefunction is linear in .. [1].作者: Distribution 時(shí)間: 2025-3-22 15:59
Atomic and Molecular Properties Using Explicitly Correlated FunctionsThis chapter presents selected theoretical and numerical results concerning first- and second-order properties of few-electron systems obtained using explicitly correlated wave functions.作者: Distribution 時(shí)間: 2025-3-22 19:36 作者: patriot 時(shí)間: 2025-3-22 22:54 作者: Bouquet 時(shí)間: 2025-3-23 02:52
Fragen zum Bilanzrichtlinien-Gesetz,Popular inconsistencies in the concept of electron correlation (in part related to an inappropriate normalization) are clarified. Current claims, e.g. that ‘there is a Fermi correlation between electrons of the same spin, and no correlation between electrons of different spin’, or that the ‘Fermi ho作者: 腫塊 時(shí)間: 2025-3-23 07:34
https://doi.org/10.1007/978-3-322-91705-8ectronic distance, ... Such functions with the correlation term .. have been proposed for the first time in 1929 by Hylleraas to solve the Schr?dinger equation for helium atom [1]. The Hylleraas wave function can be described as composed of three factors: exponential (Slater type), power expansion o作者: Mundane 時(shí)間: 2025-3-23 10:56 作者: voluble 時(shí)間: 2025-3-23 14:53
Heribert Meffert,Paul-Josef Pattrately the electron correlation effects can be accounted for. The correlation contribution usually constitutes only about 1% of the total electronic energy. Nevertheless, it plays a key role in our understanding of many phenomena of chemical interest, particularly those depending on energy differenc作者: refine 時(shí)間: 2025-3-23 22:02
Neue Einkaufszentren im Ruhrgebiet using EC wave functions. Energies calculated from the electronic Schr?dinger equation can then be used as the potential for solving the rotation-vibration problem of a molecule. This procedure (the Born-Oppenheimer, BO, approximation) neglects the coupling between the nuclear and electronic movemen作者: Mutter 時(shí)間: 2025-3-24 01:28 作者: 自由職業(yè)者 時(shí)間: 2025-3-24 04:31 作者: 我說(shuō)不重要 時(shí)間: 2025-3-24 08:38 作者: seroma 時(shí)間: 2025-3-24 12:25 作者: 淺灘 時(shí)間: 2025-3-24 17:38 作者: 不妥協(xié) 時(shí)間: 2025-3-24 20:28
Theory of Electron Correlationted. Excitation operators and .-particle density matrices play a central role. An important aspect of Fock-space theory is . of operators, which is closely related to . of properties. It is preferable to have a theory entirely in terms of additively separable quantities, such as e.g. the . of couple作者: Irremediable 時(shí)間: 2025-3-25 01:14
Explicitly Correlated Functions in Variational Calculationsns are able to achieve the spectroscopic accuracy in atomic and molecular energy calculations (errors of the order of one .hartree). Several methods using different expressions of .. dependence have been developed. They can be divided into two groups depending on the form of the correlation factor u作者: sterilization 時(shí)間: 2025-3-25 04:12 作者: 斗爭(zhēng) 時(shí)間: 2025-3-25 08:31
1567-7354 properties and to study positronic systems, resonance states of atoms and nuclear dynamics of the hydrogen molecular ion. .978-90-481-6448-6978-94-017-0313-0Series ISSN 1567-7354 Series E-ISSN 2215-0129 作者: 事物的方面 時(shí)間: 2025-3-25 15:27 作者: 過(guò)份艷麗 時(shí)間: 2025-3-25 17:45 作者: GUEER 時(shí)間: 2025-3-25 23:25
Book 2003lativistic correction using ECG functions. The last part of the book reviews applications of EC functions to calculate atomic and molecular properties and to study positronic systems, resonance states of atoms and nuclear dynamics of the hydrogen molecular ion. .作者: Decibel 時(shí)間: 2025-3-26 00:49 作者: Fluctuate 時(shí)間: 2025-3-26 04:25
Explicitly Correlated Functions in Variational Calculationsectronic distance, ... Such functions with the correlation term .. have been proposed for the first time in 1929 by Hylleraas to solve the Schr?dinger equation for helium atom [1]. The Hylleraas wave function can be described as composed of three factors: exponential (Slater type), power expansion o作者: 打火石 時(shí)間: 2025-3-26 08:54 作者: 高原 時(shí)間: 2025-3-26 14:47 作者: 阻擋 時(shí)間: 2025-3-26 19:00
Adiabatic Calculations Using Explicitly Correlated Wave Functions using EC wave functions. Energies calculated from the electronic Schr?dinger equation can then be used as the potential for solving the rotation-vibration problem of a molecule. This procedure (the Born-Oppenheimer, BO, approximation) neglects the coupling between the nuclear and electronic movemen作者: 徹底明白 時(shí)間: 2025-3-26 23:23 作者: 填滿 時(shí)間: 2025-3-27 01:44 作者: 動(dòng)脈 時(shí)間: 2025-3-27 07:26
Quantum Chemical Calculations on Positronic Systemss and spin equal to those of the electron, but with the opposite (positive) charge. The particle itself has been detected in the cosmic rays by Anderson [2] in 1933, whereas in 1946 Wheeler predicted the possibility of the stability of positronic complex systems [3]. These systems decay by annihilat作者: 脖子 時(shí)間: 2025-3-27 13:13
Resonance States of Atomstiply excited. In the one-electron picture they correspond to multiply-excited electron configurations. If the description of electron correlation is considered, that of a highly excited system is much more demanding than for the ground or singly excited state of the same system. In a multiply excit作者: 大火 時(shí)間: 2025-3-27 15:26 作者: Inferior 時(shí)間: 2025-3-27 20:58 作者: 范圍廣 時(shí)間: 2025-3-28 01:09 作者: Engulf 時(shí)間: 2025-3-28 05:58 作者: NOMAD 時(shí)間: 2025-3-28 07:54
https://doi.org/10.1007/978-3-7091-9842-1ion and are not easily accessible to the observation due to their short lifetimes (typically not exceeding 1 ns). They appeared to be a real challenge for the standard methods of computational quantum chemistry.作者: 不要嚴(yán)酷 時(shí)間: 2025-3-28 10:56 作者: 工作 時(shí)間: 2025-3-28 16:06 作者: 一大塊 時(shí)間: 2025-3-28 19:08 作者: 我的巨大 時(shí)間: 2025-3-29 00:33 作者: RENIN 時(shí)間: 2025-3-29 04:09 作者: trigger 時(shí)間: 2025-3-29 10:52
Resonance States of Atomsconsidered, that of a highly excited system is much more demanding than for the ground or singly excited state of the same system. In a multiply excited state the electron correlations contribute strongly to the binding of the system: to the energy and to the electron density distribution — to the localization of the state..作者: 果仁 時(shí)間: 2025-3-29 11:47
Personalinformationssysteme im Handelse where a degeneracy or near-degeneracy in the . is split by relativity. The last part of this chapter is devoted to ., both at the Hartree-Fock level and with inclu-sion of electron correlation. DPT is free from . and unaffected by the ..作者: Innocence 時(shí)間: 2025-3-29 15:35
Direct Perturbation Theory of Relativistic Effectsse where a degeneracy or near-degeneracy in the . is split by relativity. The last part of this chapter is devoted to ., both at the Hartree-Fock level and with inclu-sion of electron correlation. DPT is free from . and unaffected by the ..作者: 平 時(shí)間: 2025-3-29 20:31
Heribert Meffert,Paul-Josef Patton potentials, electron affinities, molecular multipoles, and polarizabilities. In weakly interacting van der Waals systems, the electron correlation is solely responsible for the major attractive component of the interaction potential — the dispersion energy.作者: 打算 時(shí)間: 2025-3-30 03:31
Politik und Gesellschaft des Nahen Ostens the vibration-rotation spectrum in the infrared (Carney and Porter, 1976 [7]; Watson, 1984 [8,9]; Sutcliffe and Tennyson, 1987 [10]). The detection of H. had to await the age of laser spectroscopy (Oka, 1980 [11]).作者: 出處 時(shí)間: 2025-3-30 06:26 作者: SPASM 時(shí)間: 2025-3-30 08:49
Quantum Nuclear Dynamics of the H 3 + -System and Its Isotopomers the vibration-rotation spectrum in the infrared (Carney and Porter, 1976 [7]; Watson, 1984 [8,9]; Sutcliffe and Tennyson, 1987 [10]). The detection of H. had to await the age of laser spectroscopy (Oka, 1980 [11]).
