نتائج البحث - "Cotton, Stephen J"

1

Academic Journal

The Role of Spin–Orbit Coupling in the Linear Absorption Spectrum and Intersystem Crossing Rate Coefficients of Ruthenium Polypyridyl Dyes

المؤلفون: Talbot, Justin J, Cheshire, Thomas P, Cotton, Stephen J, Houle, Frances A, Head-Gordon, Martin

المصدر: The Journal of Physical Chemistry A. 128(37)

مصطلحات موضوعية: Physical Sciences, Chemical Sciences, Physical Chemistry, Theoretical and Computational Chemistry, 1.1 Normal biological development and functioning, Atomic, Molecular, Nuclear, Particle and Plasma Physics, Physical Chemistry (incl. Structural), Physical chemistry, Theoretical and computational chemistry, Atomic, molecular and optical physics

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/8273n63f
https://escholarship.org/content/qt8273n63f/qt8273n63f.pdf

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2

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The Role of Spin-Orbit Coupling on the Linear Absorption Spectrum and Intersystem Crossing Rate Coefficients of Ruthenium Polypyridyl Dyes

المؤلفون: Talbot, Justin J., Cheshire, Thomas P., Cotton, Stephen J., Houle, Frances A., Head-Gordon, Martin

مصطلحات موضوعية: Physics - Chemical Physics, Quantum Physics

URL الوصول: http://arxiv.org/abs/2406.12234

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3

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Fantastical Excited State Optimized Structures and Where to Find Them

المؤلفون: Talbot, Justin J., Arias-Martinez, Juan E., Cotton, Stephen J., Head-Gordon, Martin

مصطلحات موضوعية: Physics - Chemical Physics

URL الوصول: http://arxiv.org/abs/2308.06475

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4

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The symmetric quasi-classical model using on-the-fly time-dependent density functional theory within the Tamm-Dancoff approximation

المؤلفون: Talbot, Justin J., Head-Gordon, Martin, Cotton, Stephen J.

مصطلحات موضوعية: Physics - Chemical Physics

URL الوصول: http://arxiv.org/abs/2209.11831

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5

Academic Journal

The symmetric quasi-classical model using on-the-fly time-dependent density functional theory within the Tamm–Dancoff approximation

المؤلفون: Talbot, Justin J, Head-Gordon, Martin, Cotton, Stephen J

المصدر: Molecular Physics. 121(7-8)

مصطلحات موضوعية: Chemical Sciences, Physical Chemistry, Theoretical and Computational Chemistry, Bioengineering, Quasi-classical nonadiabatic dynamics, time-dependent density functional theory, molecular dynamics, Atomic, Molecular, Nuclear, Particle and Plasma Physics, Physical Chemistry (incl. Structural), Chemical Physics, Physical chemistry, Theoretical and computational chemistry

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/9k29v71p
https://escholarship.org/content/qt9k29v71p/qt9k29v71p.pdf

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6

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A truncated Davidson method for the efficient 'chemically accurate' calculation of full configuration interaction wavefunctions without any large matrix diagonalization

المؤلفون: Cotton, Stephen J.

مصطلحات موضوعية: Physics - Chemical Physics, Physics - Atomic Physics, Physics - Computational Physics, Quantum Physics

URL الوصول: http://arxiv.org/abs/2207.12587

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7

Academic Journal

Real-Time Evolution for Ultracompact Hamiltonian Eigenstates on Quantum Hardware

المؤلفون: Klymko, Katherine, Mejuto-Zaera, Carlos, Cotton, Stephen J, Wudarski, Filip, Urbanek, Miroslav, Hait, Diptarka, Head-Gordon, Martin, Whaley, K Birgitta, Moussa, Jonathan, Wiebe, Nathan, de Jong, Wibe A, Tubman, Norm M

المصدر: PRX Quantum. 3(2)

مصطلحات موضوعية: Quantum Physics, Atomic, Molecular and Optical Physics, Physical Sciences

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/7839h8dx

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8

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Quantum Alternating Operator Ansatz (QAOA) Phase Diagrams and Applications for Quantum Chemistry

المؤلفون: Kremenetski, Vladimir, Hogg, Tad, Hadfield, Stuart, Cotton, Stephen J., Tubman, Norm M.

مصطلحات موضوعية: Quantum Physics, Condensed Matter - Materials Science, Condensed Matter - Strongly Correlated Electrons

URL الوصول: http://arxiv.org/abs/2108.13056

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9

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Simulation of adiabatic quantum computing for molecular ground states

المؤلفون: Kremenetski, Vladimir, Mejuto-Zaera, Carlos, Cotton, Stephen J., Tubman, Norm M.

مصطلحات موضوعية: Quantum Physics, Physics - Chemical Physics, Physics - Computational Physics

URL الوصول: http://arxiv.org/abs/2103.12059

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10

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Real time evolution for ultracompact Hamiltonian eigenstates on quantum hardware

المؤلفون: Klymko, Katherine, Mejuto-Zaera, Carlos, Cotton, Stephen J., Wudarski, Filip, Urbanek, Miroslav, Hait, Diptarka, Head-Gordon, Martin, Whaley, K. Birgitta, Moussa, Jonathan, Wiebe, Nathan, de Jong, Wibe A., Tubman, Norm M.

مصطلحات موضوعية: Quantum Physics, Condensed Matter - Strongly Correlated Electrons

URL الوصول: http://arxiv.org/abs/2103.08563

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11

Academic Journal

Dynamic signatures of electronically nonadiabatic coupling in sodium hydride: a rigorous test for the symmetric quasi-classical model applied to realistic, ab initio electronic states in the adiabatic representation

المؤلفون: Talbot, Justin J, Head-Gordon, Martin, Miller, William H, Cotton, Stephen J

المصدر: Physical Chemistry Chemical Physics. 24(8)

مصطلحات موضوعية: Chemical Sciences, Physical Chemistry, Theoretical and Computational Chemistry, Physical Sciences, Atomic, Molecular and Optical Physics, Bioengineering, Engineering, Chemical Physics, Chemical sciences, Physical sciences

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/1b66v7x5
https://escholarship.org/content/qt1b66v7x5/qt1b66v7x5.pdf

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12

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Observation of separated dynamics of charge and spin in the Fermi-Hubbard model

المؤلفون: Arute, Frank, Arya, Kunal, Babbush, Ryan, Bacon, Dave, Bardin, Joseph C., Barends, Rami, Bengtsson, Andreas, Boixo, Sergio, Broughton, Michael, Buckley, Bob B., Buell, David A., Burkett, Brian, Bushnell, Nicholas, Chen, Yu, Chen, Zijun, Chen, Yu-An, Chiaro, Ben, Collins, Roberto, Cotton, Stephen J., Courtney, William, Demura, Sean, Derk, Alan, Dunsworth, Andrew, Eppens, Daniel, Eckl, Thomas, Erickson, Catherine, Farhi, Edward, Fowler, Austin, Foxen, Brooks, Gidney, Craig, Giustina, Marissa, Graff, Rob, Gross, Jonathan A., Habegger, Steve, Harrigan, Matthew P., Ho, Alan, Hong, Sabrina, Huang, Trent, Huggins, William, Ioffe, Lev B., Isakov, Sergei V., Jeffrey, Evan, Jiang, Zhang, Jones, Cody, Kafri, Dvir, Kechedzhi, Kostyantyn, Kelly, Julian, Kim, Seon, Klimov, Paul V., Korotkov, Alexander N., Kostritsa, Fedor, Landhuis, David, Laptev, Pavel, Lindmark, Mike, Lucero, Erik, Marthaler, Michael, Martin, Orion, Martinis, John M., Marusczyk, Anika, McArdle, Sam, McClean, Jarrod R., McCourt, Trevor, McEwen, Matt, Megrant, Anthony, Mejuto-Zaera, Carlos, Mi, Xiao, Mohseni, Masoud, Mruczkiewicz, Wojciech, Mutus, Josh, Naaman, Ofer, Neeley, Matthew, Neill, Charles, Neven, Hartmut, Newman, Michael, Niu, Murphy Yuezhen, O'Brien, Thomas E., Ostby, Eric, Pató, Bálint, Petukhov, Andre, Putterman, Harald, Quintana, Chris, Reiner, Jan-Michael, Roushan, Pedram, Rubin, Nicholas C., Sank, Daniel, Satzinger, Kevin J., Smelyanskiy, Vadim, Strain, Doug, Sung, Kevin J., Schmitteckert, Peter, Szalay, Marco, Tubman, Norm M., Vainsencher, Amit, White, Theodore, Vogt, Nicolas, Yao, Z. Jamie, Yeh, Ping, Zalcman, Adam, Zanker, Sebastian

مصطلحات موضوعية: Quantum Physics

URL الوصول: http://arxiv.org/abs/2010.07965

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13

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Are multi-quasiparticle interactions important in molecular ionization?

المؤلفون: Mejuto-Zaera, Carlos, Weng, Guorong, Romanova, Mariya, Cotton, Stephen J., Whaley, K. Birgitta, Tubman, Norm M., Vlček, Vojtěch

المصدر: J. Chem. Phys. 154, 121101 (2021)

مصطلحات موضوعية: Physics - Chemical Physics

URL الوصول: http://arxiv.org/abs/2009.02401

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14

Academic Journal

Classical molecular dynamics simulation of electronically non-adiabatic processes

المؤلفون: Miller, William H, Cotton, Stephen J

مصطلحات موضوعية: Chemical Sciences, Physical Chemistry, Chemical Physics, Chemical sciences

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/1bq8b4wq
https://escholarship.org/content/qt1bq8b4wq/qt1bq8b4wq.pdf

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15

Academic Journal

A new symmetrical quasi-classical model for electronically non-adiabatic processes: Application to the case of weak non-adiabatic coupling

المؤلفون: Cotton, Stephen J, Miller, William H

المصدر: The Journal of Chemical Physics. 145(14)

مصطلحات موضوعية: Physical Sciences, Chemical Sciences, Physical Chemistry, Engineering, Chemical Physics, Chemical sciences, Physical sciences

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/8v54t2x7
https://escholarship.org/content/qt8v54t2x7/qt8v54t2x7.pdf

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16

Academic Journal

Communication: Wigner functions in action-angle variables, Bohr-Sommerfeld quantization, the Heisenberg correspondence principle, and a symmetrical quasi-classical approach to the full electronic density matrix

المؤلفون: Miller, William H, Cotton, Stephen J

المصدر: The Journal of Chemical Physics. 145(8)

مصطلحات موضوعية: Physical Sciences, Chemical Sciences, Physical Chemistry, Engineering, Chemical Physics, Chemical sciences, Physical sciences

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/5mm9q47c
https://escholarship.org/content/qt5mm9q47c/qt5mm9q47c.pdf

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17

Academic Journal

The Symmetrical Quasi-Classical Model for Electronically Non-Adiabatic Processes Applied to Energy Transfer Dynamics in Site-Exciton Models of Light-Harvesting Complexes

المؤلفون: Cotton, Stephen J, Miller, William H

المصدر: Journal of Chemical Theory and Computation. 12(3)

مصطلحات موضوعية: Chemical Sciences, Physical Chemistry, Affordable and Clean Energy, Theoretical and Computational Chemistry, Biochemistry and Cell Biology, Computer Software, Chemical Physics, Physical chemistry, Theoretical and computational chemistry

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/1hx098qf
https://escholarship.org/content/qt1hx098qf/qt1hx098qf.pdf

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18

Academic Journal

A Symmetrical Quasi-Classical Spin-Mapping Model for the Electronic Degrees of Freedom in Non-Adiabatic Processes

المؤلفون: Cotton, Stephen J, Miller, William H

المصدر: The Journal of Physical Chemistry A. 119(50)

مصطلحات موضوعية: Physical Sciences, Chemical Sciences, Atomic, Molecular and Optical Physics, Physical Chemistry, Atomic, Molecular, Nuclear, Particle and Plasma Physics, Physical Chemistry (incl. Structural), Theoretical and Computational Chemistry, Physical chemistry, Theoretical and computational chemistry, Atomic, molecular and optical physics

وصف الملف: application/pdf

URL الوصول: https://escholarship.org/uc/item/1x01r30k
https://escholarship.org/content/qt1x01r30k/qt1x01r30k.pdf

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19

Academic Journal

Are multi-quasiparticle interactions important in molecular ionization?

المؤلفون: Mejuto-Zaera, Carlos, Weng, Guorong, Romanova, Mariya, Cotton, Stephen J., Whaley, K. Birgitta, Tubman, Norm M., Vlček, Vojtěch

المصدر: Journal of Chemical Physics; 3/28/2021, Vol. 154 Issue 12, p1-7, 7p

مصطلحات موضوعية: MOLECULAR interactions, QUASIPARTICLES, PERTURBATION theory, SMALL molecules, EXCITATION spectrum

20

Academic Journal

Trajectory-adjusted electronic zero point energy in classical Meyer-Miller vibronic dynamics: Symmetrical quasiclassical application to photodissociation.

المؤلفون: Cotton, Stephen J.¹ (AUTHOR) StephenJCotton47@gmail.com, Miller, William H.¹ (AUTHOR) MillerWH@berkeley.edu

المصدر: Journal of Chemical Physics. 5/21/2019, Vol. 150 Issue 19, pN.PAG-N.PAG. 9p. 2 Charts, 5 Graphs.

مصطلحات موضوعية: *ZERO point energy, *PHOTODISSOCIATION, *MOLECULAR dynamics, *GROUND state energy, *DEGREES of freedom, *JAHN-Teller effect

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