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Longer titles found: Multireference configuration interaction (view), Quadratic configuration interaction (view), Full configuration interaction (view)

searching for Configuration interaction 35 found (125 total)

alternate case: configuration interaction

Ugo Fano (1,002 words) [view diff] exact match in snippet view article find links to article

urging of Fermi, Fano developed his seminal theory of resonant configuration interaction (Fano resonance profile), which led to two papers, in 1935 and
Variational Monte Carlo (1,874 words) [view diff] exact match in snippet view article find links to article
electronic correlation) with less than 30 parameters. In comparison, a configuration interaction calculation may require around 50,000 parameters to reach that
Silicon monosulfide (277 words) [view diff] case mismatch in snippet view article find links to article
Kalyan Kumar (2002). "Electronic Spectrum of Silicon Monosulfide: Configuration Interaction Study". The Journal of Physical Chemistry A. 106 (5): 833. Bibcode:2002JPCA
Katheryn Edmonds Rajnak (461 words) [view diff] exact match in snippet view article find links to article
chemistry in 1959, magna cum laude. She defended her doctoral thesis, Configuration interaction in the rare earths and its effect on the stark levels of PrCl₃
TeraChem (846 words) [view diff] case mismatch in snippet view article find links to article
2, 1789-1793 (2011) Excited-State Electronic Structure with Configuration Interaction Singles and Tamm-Dancoff Time-Dependent Density Functional Theory
Molecular vibration (2,724 words) [view diff] exact match in snippet view article find links to article
2nd order vibrational perturbation theory (VPT2) or vibrational configuration interaction theory (VCI). In an infrared spectrum the intensity of an absorption
Matrix isolation (1,135 words) [view diff] exact match in snippet view article find links to article
synergy of matrix-isolation infrared spectroscopy and vibrational configuration interaction computations". Theoretical Chemistry Accounts. 139 (12): 174.
Ali Alavi (709 words) [view diff] no match in snippet view article find links to article
"Communications: Survival of the fittest: Accelerating convergence in full configuration-interaction quantum Monte Carlo". The Journal of Chemical Physics. 132 (4):
Phosphorus monoxide (1,597 words) [view diff] exact match in snippet view article find links to article
4336–4343. doi:10.1021/om000274v. de Brouckère, G. (December 2000). "Configuration interaction calculations of miscellaneous properties of the C'2Δ excited state
Graphical unitary group approach (373 words) [view diff] case mismatch in snippet view article find links to article
1088/0031-8949/21/3-4/013. D.C. Sherrill; H.F. Schaeffer III (1999). The Configuration Interaction Method: Advances in Highly Correlated Approaches. Advances in
Fano resonance (1,109 words) [view diff] case mismatch in snippet view article find links to article
cond-mat/0211452 21 November 2002 Fano, U. (15 December 1961). "Effects of Configuration Interaction on Intensities and Phase Shifts". Physical Review. 124 (6). American
List of computational chemists (1,019 words) [view diff] exact match in snippet view article find links to article
Peyerimhoff (1937–), contributed to the development of multireference configuration interaction John Pople (1925–2004), winner of 1998 Nobel Prize in Chemistry
X-ray absorption fine structure (1,522 words) [view diff] exact match in snippet view article find links to article
interaction with the core hole. Multi-electron excitations and configuration interaction between many body final states dominate the edge region in strongly
Electron configurations of the elements (data page) (1,165 words) [view diff] exact match in snippet view article
1134/S0012501606060029. S2CID 95738861. Retrieved 25 September 2020. configuration interaction is crucial in more than 30% of cases since its consideration leads
Electron configuration (6,206 words) [view diff] case mismatch in snippet view article find links to article
original on 3 November 2007. Retrieved 1 November 2007. "Chapter 11. Configuration Interaction". AMPAC™ 10 User Guide. Semichem, Inc. "Laboratory for Theoretical
Firefly luciferase (1,626 words) [view diff] exact match in snippet view article find links to article
firefly, Photinus pyralis, studied by the symmetry-adapted cluster-configuration interaction method". Journal of the American Chemical Society. 129 (28): 8756–8765
Arthur M. Lesk (1,577 words) [view diff] case mismatch in snippet view article find links to article
University European Molecular Biology Laboratory Thesis Valence Bond Configuration Interaction Studies on the Chemical Bonding of the Noble Gases (1966) Website
David Sherrill (763 words) [view diff] exact match in snippet view article find links to article
working with Professor Henry F. Schefer, III on highly correlated configuration interaction methods. He was an NSF Postdoctoral Fellow in the laboratory of
Hypervalent molecule (4,517 words) [view diff] exact match in snippet view article find links to article
Goddard, John D.; Schaefer, Henry F. (February 1981). "Analytic configuration interaction gradient studies of SH 4, sulfurane". The Journal of Chemical
Josef Paldus (517 words) [view diff] exact match in snippet view article find links to article
1103/PhysRevA.5.50. Paldus, J. (1974). "Group theoretical approach to the configuration interaction and perturbation theory calculations of atomic and molecular systems"
George F. Koster (163 words) [view diff] case mismatch in snippet view article find links to article
completed his doctoral dissertation in 1951, titled The Effects of Configuration Interaction on the Hyperfine Structure, advised by Bernard Taub Feld at the
Feshbach resonance (1,851 words) [view diff] case mismatch in snippet view article find links to article
ISSN 0029-6341. S2CID 119640917. Fano, U. (1961-12-15). "Effects of Configuration Interaction on Intensities and Phase Shifts". Physical Review. 124 (6). American
Henry F. Schaefer III (2,435 words) [view diff] case mismatch in snippet view article find links to article
Berkeley University of Texas at Austin University of Georgia Thesis Configuration Interaction Wave Functions and the Properties of Atoms and Diatomic Molecules (1969)
Feshbach–Fano partitioning (692 words) [view diff] case mismatch in snippet view article find links to article
1016/0003-4916(62)90221-X. ISSN 0003-4916. Fano, U. (1961). "Effects of Configuration Interaction on Intensities and Phase Shifts". Physical Review. 124 (6): 1866–1878
Shinken (software) (1,458 words) [view diff] no match in snippet view article
Web interface that provides near real time status information, configuration, interaction, a dashboard to visualize trending data from Graphite databases
Stephan W. Koch (1,552 words) [view diff] no match in snippet view article find links to article
quantum-confinement properties. He and his coworkers demonstrated the configuration-interaction approach and its application to the optical properties of strongly
Robert J. Harrison (788 words) [view diff] exact match in snippet view article find links to article
group-IIIA–group-VA heteronuclear diatomics: BN, BP, AlN, and AlP from full configuration interaction calculations". The Journal of Chemical Physics. 125 (12): 124311
LOBPCG (4,433 words) [view diff] case mismatch in snippet view article find links to article
PMID 26940542. Shao, Meiyue; et al. (2018). "Accelerating Nuclear Configuration Interaction Calculations through a Preconditioned Block Iterative Eigensolver"
Superstripes (2,313 words) [view diff] exact match in snippet view article find links to article
pair transfer term between different condensates. The quantum configuration interaction between different pairing channels is a particular case of shape
Xenon monochloride (22,323 words) [view diff] exact match in snippet view article find links to article
relation to state C is theoretically justified by considering the configuration interaction between the ionic and covalent character states of similar symmetry
3-j symbol (5,972 words) [view diff] exact match in snippet view article find links to article
1666151. Paldus, Josef (1974). "Group theoretical approach to the configuration interaction and perturbation theory calculations for atomic and molecular
Serena DeBeer (2,547 words) [view diff] case mismatch in snippet view article find links to article
DeBeer, Serena; Neese, Frank (2017-10-02). "A Restricted Open Configuration Interaction with Singles Method To Calculate Valence-to-Core Resonant X-ray
Barbara Paldus (1,034 words) [view diff] exact match in snippet view article find links to article
Paldus, Josef (1974-12-15). "Group theoretical approach to the configuration interaction and perturbation theory calculations for atomic and molecular
List of Italian inventions and discoveries (26,253 words) [view diff] case mismatch in snippet view article find links to article
cond-mat/0211452 21 November 2002 Fano, U. (15 December 1961). "Effects of Configuration Interaction on Intensities and Phase Shifts". Physical Review. 124 (6): 1866–1878
Quantum computational chemistry (3,376 words) [view diff] case mismatch in snippet view article find links to article
initialized in a state, which has a nonzero overlap with the Full Configuration Interaction (FCI) target eigenstate of the system. This state | ψ ⟩ {\displaystyle