Matrix product operators, matrix product states, and ab initio density matrix renormalization group algorithms (English)
- New search for: Chan, Garnet Kin-Lic
- New search for: Keselman, Anna
- New search for: Nakatani, Naoki
- New search for: Li, Zhendong
- New search for: White, Steven R.
- New search for: Chan, Garnet Kin-Lic
- New search for: Keselman, Anna
- New search for: Nakatani, Naoki
- New search for: Li, Zhendong
- New search for: White, Steven R.
In:
The Journal of Chemical Physics
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145
, 1
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15
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2016
- Article (Journal) / Electronic Resource
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Title:Matrix product operators, matrix product states, and ab initio density matrix renormalization group algorithms
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Contributors:Chan, Garnet Kin-Lic ( author ) / Keselman, Anna ( author ) / Nakatani, Naoki ( author ) / Li, Zhendong ( author ) / White, Steven R. ( author )
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Published in:The Journal of Chemical Physics ; 145, 1 ; 15
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Publisher:
- New search for: AIP Publishing LLC
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Publication date:2016-07-07
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Size:15 pages
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ISSN:
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DOI:
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Type of media:Article (Journal)
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Type of material:Electronic Resource
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Language:English
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Keywords:
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Source:
Table of contents – Volume 145, Issue 1
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
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Communication: XUV transient absorption spectroscopy of iodomethane and iodobenzene photodissociationDrescher, L. / Galbraith, M. C. E. / Reitsma, G. / Dura, J. / Zhavoronkov, N. / Patchkovskii, S. / Vrakking, M. J. J. / Mikosch, J. et al. | 2016
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Thermally and vibrationally induced conformational isomerizations, infrared spectra, and photochemistry of gallic acid in low-temperature matricesJustino, Licínia L. G. / Reva, Igor / Fausto, Rui et al. | 2016
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Infrared spectroscopy of molecular ions in selected rotational and spin-orbit statesJacovella, U. / Agner, J. A. / Schmutz, H. / Deiglmayr, J. / Merkt, F. et al. | 2016
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Molecular dynamics simulation of a binary mixture near the lower critical pointPousaneh, Faezeh / Edholm, Olle / Maciołek, Anna et al. | 2016
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Computational study of effect of water finger on ion transport through water-oil interfaceKikkawa, Nobuaki / Wang, Lingjian / Morita, Akihiro et al. | 2016
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Asymmetrical phase separation and gelation in binary mixtures of oppositely charged colloidsZong, Yiwu / Yuan, Guangcui / Han, Charles C. et al. | 2016
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Winding angles of long lattice walksHammer, Yosi / Kantor, Yacov et al. | 2016
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Mode localization in the cooperative dynamics of protein recognitionCopperman, J. / Guenza, M. G. et al. | 2016
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Electric-field-driven electron-transfer in mixed-valence moleculesBlair, Enrique P. / Corcelli, Steven A. / Lent, Craig S. et al. | 2016
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Dielectric constant of water in the interfaceDinpajooh, Mohammadhasan / Matyushov, Dmitry V. et al. | 2016
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Communication: Energy transfer and reaction dynamics for DCl scattering on Au(111): An ab initio molecular dynamics studyKolb, Brian / Guo, Hua et al. | 2016
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Long-lived coherence in pentafluorobenzene as a probe of ππ* – πσ* vibronic couplingHüter, O. / Sala, M. / Neumann, H. / Zhang, S. / Studzinski, H. / Egorova, D. / Temps, F. et al. | 2016
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Maximum efficiency of state-space models of nanoscale energy conversion devicesEinax, Mario / Nitzan, Abraham et al. | 2016
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Accurate Monte Carlo simulations on FCC and HCP Lennard-Jones solids at very low temperatures and high reduced densities up to 1.30Adidharma, Hertanto / Tan, Sugata P. et al. | 2016
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First principles prediction of amorphous phases using evolutionary algorithmsNahas, Suhas / Gaur, Anshu / Bhowmick, Somnath et al. | 2016
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Matrix product operators, matrix product states, and ab initio density matrix renormalization group algorithmsChan, Garnet Kin-Lic / Keselman, Anna / Nakatani, Naoki / Li, Zhendong / White, Steven R. et al. | 2016
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Dynamic signature of molecular association in methanolBertrand, C. E. / Self, J. L. / Copley, J. R. D. / Faraone, A. et al. | 2016
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Geometric and energetic considerations of surface fluctuations during ion transfer across the water-immiscible organic liquid interfaceKarnes, John J. / Benjamin, Ilan et al. | 2016
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Infrared absorption of t-HOCO+, H+(CO2)2, and HCO2− produced in electron bombardment of CO2 in solid para-H2Das, Prasanta / Tsuge, Masashi / Lee, Yuan-Pern et al. | 2016
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Erratum: “Coupled-cluster based basis sets for valence correlation calculations” [J. Chem. Phys. 144, 104106 (2016)]Claudino, Daniel / Gargano, Ricardo / Bartlett, Rodney J. et al. | 2016
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Improved scaling of temperature-accelerated dynamics using localizationShim, Yunsic / Amar, Jacques G. et al. | 2016
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Stiffness parameter of brush-like polymers with rod-like side chainsNakamura, Yo et al. | 2016
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Thermal relaxation of molecular oxygen in collisions with nitrogen atomsAndrienko, Daniil A. / Boyd, Iain D. et al. | 2016
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Approach to the unfolding and folding dynamics of add A-riboswitch upon adenine dissociation using a coarse-grained elastic network modelLi, Chunhua / Lv, Dashuai / Zhang, Lei / Yang, Feng / Wang, Cunxin / Su, Jiguo / Zhang, Yang et al. | 2016
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Adlayer structure dependent ultrafast desorption dynamics in carbon monoxide adsorbed on Pd (111)Hong, Sung-Young / Xu, Pan / Camillone, Nina R. / White, Michael G. / Camillone, Nicholas et al. | 2016
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The thermal decomposition of the benzyl radical in a heated micro-reactor. II. Pyrolysis of the tropyl radicalBuckingham, Grant T. / Porterfield, Jessica P. / Kostko, Oleg / Troy, Tyler P. / Ahmed, Musahid / Robichaud, David J. / Nimlos, Mark R. / Daily, John W. / Ellison, G. Barney et al. | 2016
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Resolving the energy and temperature dependence of C6H6∗ collisional relaxation via time-dependent bath temperature measurementsWest, Niclas A. / Winner, Joshua D. / Bowersox, Rodney D. W. / North, Simon W. et al. | 2016
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Erratum: “Communication: Near-locality of exchange and correlation density functionals for 1- and 2-electron systems” [J. Chem. Phys. 144, 191101 (2016)]Sun, Jianwei / Perdew, John P. / Yang, Zenghui / Peng, Haowei et al. | 2016
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Speeding up local correlation methods: System-inherent domainsKats, Daniel et al. | 2016
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Note: From reaction-diffusion systems to confined Brownian motionMartens, S. et al. | 2016
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Spin contamination-free N-electron wave functions in the excitation-based configuration interaction treatmentAlcoba, Diego R. / Torre, Alicia / Lain, Luis / Massaccesi, Gustavo E. / Oña, Ofelia B. / Capuzzi, Pablo et al. | 2016
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A semi-analytical calculation of the electrostatic pair interaction between nonuniformly charged colloidal spheres at an air-water interfaceLian, Zengju et al. | 2016
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Electrostatics of polymer translocation events in electrolyte solutionsBuyukdagli, Sahin / Ala-Nissila, T. et al. | 2016
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Hydrodynamic interaction between particles near elastic interfacesDaddi-Moussa-Ider, Abdallah / Gekle, Stephan et al. | 2016
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Extension of the basis set of linearized augmented plane wave (LAPW) method by using supplemented tight binding basis functionsNikolaev, A. V. / Lamoen, D. / Partoens, B. et al. | 2016
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Full-dimensional global potential energy surfaces describing abstraction and exchange for the H + H2S reactionLu, Dandan / Li, Jun et al. | 2016
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Ab initio study of vacancy formation in cubic LaMnO3 and SmCoO3 as cathode materials in solid oxide fuel cellsOlsson, Emilia / Aparicio-Anglès, Xavier / de Leeuw, Nora H. et al. | 2016
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Laplace-transformed atomic orbital-based Møller–Plesset perturbation theory for relativistic two-component HamiltoniansHelmich-Paris, Benjamin / Repisky, Michal / Visscher, Lucas et al. | 2016