TOSCA

TOSCA is an indirect-geometry spectrometer at the ISIS Neutron and Muon Source. [1]

References

Versions

TFXA

For details on the parameters associated with the TFXA version, please see the TFXA data.

Models

book

This is the recommended book model - it is an alias for the book_v1 model, which is the model actually containing the data.

Important

book refers to the best version of this model - using a specific version may run the risk using a model with known bugs or other issues and is not advisable unless replicating the results of a given version of the model.

book_v1

This section contains the data for the TFXA instrument associated with the book_v1 model. For more information about how the model works and its implementation, please see resins.models.tosca_book.ToscaBookModel. For more information on the model parameters, please see book_v1 model data.

Configurations:

TOSCA1

For details on the parameters associated with the TOSCA1 version, please see the TOSCA1 data.

Models

book

This is the recommended book model - it is an alias for the book_v1 model, which is the model actually containing the data.

Important

book refers to the best version of this model - using a specific version may run the risk using a model with known bugs or other issues and is not advisable unless replicating the results of a given version of the model.

book_v1

This section contains the data for the TOSCA1 instrument associated with the book_v1 model. For more information about how the model works and its implementation, please see resins.models.tosca_book.ToscaBookModel. For more information on the model parameters, please see book_v1 model data.

Configurations:

TOSCA

For details on the parameters associated with the TOSCA version, please see the TOSCA data.

Models

AbINS

This is the recommended AbINS model - it is an alias for the AbINS_v1 model, which is the model actually containing the data.

Important

AbINS refers to the best version of this model - using a specific version may run the risk using a model with known bugs or other issues and is not advisable unless replicating the results of a given version of the model.

AbINS_v1

This section contains the data for the TOSCA instrument associated with the AbINS_v1 model. For more information about how the model works and its implementation, please see resins.models.polynomial.PolynomialModel1D. For more information on the model parameters, please see AbINS_v1 model data.

Configurations: NONE

book

This is the recommended book model - it is an alias for the book_v1 model, which is the model actually containing the data.

Important

book refers to the best version of this model - using a specific version may run the risk using a model with known bugs or other issues and is not advisable unless replicating the results of a given version of the model.

book_v1

This section contains the data for the TOSCA instrument associated with the book_v1 model. For more information about how the model works and its implementation, please see resins.models.tosca_book.ToscaBookModel. For more information on the model parameters, please see book_v1 model data.

Configurations:

vision

This is the recommended vision model - it is an alias for the vision_v1 model, which is the model actually containing the data.

Important

vision refers to the best version of this model - using a specific version may run the risk using a model with known bugs or other issues and is not advisable unless replicating the results of a given version of the model.

vision_v1

This section contains the data for the TOSCA instrument associated with the vision_v1 model. For more information about how the model works and its implementation, please see resins.models.vision_paper.VisionPaperModel. For more information on the model parameters, please see vision_v1 model data.

Configurations:

Data

name: "TOSCA"
default_version: "TOSCA"
version:
    TFXA:
        default_model: "book"
        models:
            book: "book_v1"
            book_v1:
                function: "tosca_book"
                citation: ['PCH Mitchell, SF Parker, AJ Ramirez-Cuesta, and J Tomkinson, Vibrational Spectroscopy with Neutrons, World Scientific, Singapore, 2005. ISBN 981-256-013-0']
                parameters:
                    defaults:
                    restrictions:
                    primary_flight_path: 12.13
                    primary_flight_path_uncertainty: 0.0021
                    water_moderator_constant: 44
                    time_channel_uncertainty: 2
                    sample_thickness: 0.002
                    graphite_thickness: 0.002
                    detector_thickness: 0.006
                    sample_width: 0.02
                    detector_width: 0.012
                    crystal_plane_spacing: 3.348e-10
                configurations:
                    detector_bank:
                        default_option: "Backward"
                        Backward:
                            angles: [134.98885653282196]
                            average_secondary_flight_path: 0.671
                            average_final_energy: 3.909
                            average_bragg_angle_graphite: 43.0
                            change_average_bragg_angle_graphite: 5.637684123246608
    TOSCA1:
        default_model: "book"
        models:
            book: "book_v1"
            book_v1:
                function: "tosca_book"
                citation: ['PCH Mitchell, SF Parker, AJ Ramirez-Cuesta, and J Tomkinson, Vibrational Spectroscopy with Neutrons, World Scientific, Singapore, 2005. ISBN 981-256-013-0']
                parameters:
                    defaults:
                    restrictions:
                    primary_flight_path: 12.264
                    primary_flight_path_uncertainty: 0.0021
                    water_moderator_constant: 44
                    time_channel_uncertainty: 2
                    sample_thickness: 0.002
                    graphite_thickness: 0.002
                    detector_thickness: 0.0025
                    sample_width: 0.02
                    detector_width: 0.012
                    crystal_plane_spacing: 3.348e-10
                configurations:
                    detector_bank:
                        default_option: "Backward"
                        Backward:
                            angles: [134.98885653282196]
                            average_secondary_flight_path: 0.7456
                            average_final_energy: 3.51
                            average_bragg_angle_graphite: 46.03
                            change_average_bragg_angle_graphite: 5.0814852427945665
    TOSCA:
        default_model: "AbINS"
        models:
            AbINS: "AbINS_v1"
            AbINS_v1:
                function: "polynomial_1d"
                citation: ['K. Dymkowski, S. F. Parker, F. Fernandez-Alonso, S. Mukhopadhyay, Phys. B: Condens. Matter, 2018, 551, 443-448. https://doi.org/10.1016/j.physb.2018.02.034.', 'Y. Q. Cheng, L. L. Daemen, A. I. Kolesnikov, and A. J. Ramirez-Cuesta, J. Chem. Theory Comput., 2019, 15, 1974-1982. https://doi.org/10.1021/acs.jctc.8b01250']
                parameters:
                    defaults:
                    restrictions:
                    fit: [0.3099604960830007, 0.005, 8.065543937349209e-07]
                configurations: {}
            book: "book_v1"
            book_v1:
                function: "tosca_book"
                citation: ['PCH Mitchell, SF Parker, AJ Ramirez-Cuesta, and J Tomkinson, Vibrational Spectroscopy with Neutrons, World Scientific, Singapore, 2005. ISBN 981-256-013-0']
                parameters:
                    defaults:
                    restrictions:
                    primary_flight_path: 17.0
                    primary_flight_path_uncertainty: 0.0021
                    sample_thickness: 0.002
                    detector_thickness: 0.0025
                    crystal_plane_spacing: 3.348e-10
                    water_moderator_constant: 44
                    time_channel_uncertainty: 2
                    graphite_thickness: 0.002
                    sample_width: 0.04
                    detector_width: 0.12
                configurations:
                    detector_bank:
                        default_option: "Backward"
                        Backward:
                            angles: [134.98885653282196]
                            average_bragg_angle_graphite: 47.73
                            average_final_energy: 3.32
                            average_secondary_flight_path: 0.6279
                            change_average_bragg_angle_graphite: 17.439366410966983
                        Forward:
                            angles: [45.0]
                            average_bragg_angle_graphite: 47.45
                            average_final_energy: 3.35
                            average_secondary_flight_path: 0.6279
                            change_average_bragg_angle_graphite: 17.59374274222979
            vision: "vision_v1"
            vision_v1:
                function: "vision_paper"
                citation: ['P. A. Seeger, L. L. Daemen, and J. Z. Larese, Nucl. Instrum. Methods Phys. Res., Sect. A, 2009, 604, 3, 719-728. https://doi.org/10.1016/j.nima.2009.03.204']
                parameters:
                    defaults:
                    restrictions:
                    primary_flight_path: 17.0
                    primary_flight_path_uncertainty: 0.0021
                    sample_thickness: 0.002
                    detector_thickness: 0.0025
                    crystal_plane_spacing: 3.348e-10
                    d_r: 1.29e-05
                    d_t: None
                configurations:
                    detector_bank:
                        default_option: "Backward"
                        Backward:
                            angles: [134.98885653282196]
                            average_bragg_angle_graphite: 47.73
                            distance_sample_analyzer: 0.23231778281139834
                        Forward:
                            angles: [45.0]
                            average_bragg_angle_graphite: 47.45
                            distance_sample_analyzer: 0.2312830382624369