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Universal expressiveness of variational quantum classifiers and quantum kernels for support vector machines

Nature communications, 2023-02, Vol.14 (1), p.576-576, Article 576

2023

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Light Bipolarons Stabilized by Peierls Electron-Phonon Coupling

Physical review letters, 2018-12, Vol.121 (24), p.247001-247001, Article 247001

2018

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Neural networks vs Gaussian process regression for representing potential energy surfaces: A comparative study of fit quality and vibrational spectrum accuracy

The Journal of chemical physics, 2018-06, Vol.148 (24), p.241702-241702

2018

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Molecules in Electromagnetic Fields: From Ultracold Physics to Controlled Chemistry

Krems, Roman V

1, 2018

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Cross-calibration of atomic pressure sensors and deviation from quantum diffractive collision universality for light particles

New journal of physics, 2023-05, Vol.25 (5), p.53018

2023

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Universality of quantum diffractive collisions and the quantum pressure standard

New journal of physics, 2019-10, Vol.21 (10), p.102001

2019

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A general method for controlling and resolving rotational orientation of molecules in molecule-surface collisions

Nature communications, 2017-05, Vol.8 (1), p.15357-15357, Article 15357

2017

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Efficient non-parametric fitting of potential energy surfaces for polyatomic molecules with Gaussian processes

Journal of physics. B, Atomic, molecular, and optical physics, 2016-11, Vol.49 (22), p.224001

2016

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Efficient interpolation of molecular properties across chemical compound space with low-dimensional descriptors

Machine learning: science and technology, 2024-03, Vol.5 (1), p.15059

2024

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Cold and ultracold molecules: science, technology and applications

New journal of physics, 2009-05, Vol.11 (5), p.055049

2009

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Manipulation of molecules with electromagnetic fields

Molecular physics, 2013-07, Vol.111 (12-13), p.1648-1682

2013

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Gaussian Process Model for Collision Dynamics of Complex Molecules

Physical review letters, 2015-08, Vol.115 (7), p.073202-073202, Article 073202

2015

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Rapid and Mild One‐Flow Synthetic Approach to Unsymmetrical Sulfamides Guided by Bayesian Optimization

Chemistry methods, 2021-11, Vol.1 (11), p.484-490

2021

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Extrapolating Quantum Observables with Machine Learning: Inferring Multiple Phase Transitions from Properties of a Single Phase

Physical review letters, 2018-12, Vol.121 (25), p.255702, Article 255702

2018

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General Classification of Qubit Encodings in Ultracold Diatomic Molecules

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2023-08, Vol.127 (31), p.6593-6602

2023

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Universal Probability Distributions of Scattering Observables in Ultracold Molecular Collisions

Physical review letters, 2019-07, Vol.123 (1), p.013401-013401, Article 013401

2019

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Nonadditivity of Optical and Casimir-Polder Potentials

Physical review letters, 2018-08, Vol.121 (8), p.083603-083603, Article 083603

2018

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Anderson Localization of Composite Particles

Physical review letters, 2021-10, Vol.127 (16), p.160602-160602, Article 160602

2021

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Time-Dependent Wave Packet Dynamics Calculations of Cross Sections for Ultracold Scattering of Molecules

Physical review letters, 2018-04, Vol.120 (14), p.143401-143401, Article 143401

2018

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Non-adiabatic control of quantum energy transfer in ordered and disordered arrays

New journal of physics, 2013-06, Vol.15 (6), p.63015-24

2013

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Rate Constants for Fine-structure Excitations in O-H Collisions with Error Bars Obtained by Machine Learning

The Astrophysical journal, 2017-02, Vol.835 (2), p.255

2017

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Six-dimensional potential energy surface for NaK–NaK collisions: Gaussian process representation with correct asymptotic form

The Journal of chemical physics, 2019-02, Vol.150 (6), p.064106-064106

2019

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Investigating polaron transitions with polar molecules

Physical review letters, 2013-05, Vol.110 (22), p.223002-223002, Article 223002

2013

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Tuning Bimolecular Chemical Reactions by Electric Fields

Physical review letters, 2015-07, Vol.115 (2), p.023201-023201, Article 023201

2015

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Gaussian process model for extrapolation of scattering observables for complex molecules: From benzene to benzonitrile

The Journal of chemical physics, 2015-10, Vol.143 (15), p.154101-154101

2015

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Universal expressiveness of variational quantum classifiers and quantum kernels for support vector machines

Light Bipolarons Stabilized by Peierls Electron-Phonon Coupling

Neural networks vs Gaussian process regression for representing potential energy surfaces: A comparative study of fit quality and vibrational spectrum accuracy

Molecules in Electromagnetic Fields: From Ultracold Physics to Controlled Chemistry

Cross-calibration of atomic pressure sensors and deviation from quantum diffractive collision universality for light particles

Universality of quantum diffractive collisions and the quantum pressure standard

A general method for controlling and resolving rotational orientation of molecules in molecule-surface collisions

Efficient non-parametric fitting of potential energy surfaces for polyatomic molecules with Gaussian processes

Efficient interpolation of molecular properties across chemical compound space with low-dimensional descriptors

Cold and ultracold molecules: science, technology and applications

Manipulation of molecules with electromagnetic fields

Gaussian Process Model for Collision Dynamics of Complex Molecules

Rapid and Mild One‐Flow Synthetic Approach to Unsymmetrical Sulfamides Guided by Bayesian Optimization

Extrapolating Quantum Observables with Machine Learning: Inferring Multiple Phase Transitions from Properties of a Single Phase

General Classification of Qubit Encodings in Ultracold Diatomic Molecules

Universal Probability Distributions of Scattering Observables in Ultracold Molecular Collisions

Nonadditivity of Optical and Casimir-Polder Potentials

Anderson Localization of Composite Particles

Time-Dependent Wave Packet Dynamics Calculations of Cross Sections for Ultracold Scattering of Molecules

Non-adiabatic control of quantum energy transfer in ordered and disordered arrays

Rate Constants for Fine-structure Excitations in O-H Collisions with Error Bars Obtained by Machine Learning

Six-dimensional potential energy surface for NaK–NaK collisions: Gaussian process representation with correct asymptotic form

Investigating polaron transitions with polar molecules

Tuning Bimolecular Chemical Reactions by Electric Fields

Gaussian process model for extrapolation of scattering observables for complex molecules: From benzene to benzonitrile

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