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DOE OSTI2024

Steric and Electronic Influence of Excited-State Decay in Cu(I) MLCT Chromophores

For the past eleven years, a dedicated effort in our research group focused on fundamentally advancing the photophysical properties of cuprous bis-phenanthroline-based metal-to-ligand charge transfer (MLCT) excited states. We rationalized that by gaining control over the numerous factors limiting the more widespread use of Cu I MLCT photosensitizers, they would be readily adopted in numerous light-activated applications given the earth-abundance of copper and the extensive library of 1,10-phenanthrolines developed over the last century. Significant progress has been achieved by recognizing valuable structure-property concepts developed by other researchers in tandem with detailed ultrafast and conventional time-scale investigations, in-silico-inspired molecular designs to predict spectroscopic properties, and applying novel synthetic methodologies. Ultimately, we achieved a plateau in exerting cooperative steric influence to control Cu I MLCT excited state decay. This led to combining sterics with π-conjugation and/or inductive electronic effects to further exert control over molecular photophysical properties. The lessons gleaned from our studies of homoleptic complexes were recently extended to heteroleptic bis(phenanthrolines) featuring enhanced visible light absorption properties and long-lived room-temperature photoluminescence. Furthermore, this Account navigates the reader through our intellectual journey of decision-making, molecular and experimental design, and data interpretation in parallel with appropriate background information related to the quantitative characterization of molecular photophysics using Cu I MLCT chromophores as prototypical examples.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

DOE OSTI2017

Characterizing cyber tools for monitoring power grid systems: what information is available and who needs it?

Abstract—The power grid is a complex, interconnected system that requires the coordination of multiple entities ensure the reliability of the system. System operators must be aware of the impacts of various natural and man-made contingencies through telemetry from their control systems, and they must also be aware of the integrity and availability of the cyber assets on their systems. A team of researchers from PNNL and INL have conducted a series of observations and interviews at power utilities to identify what information needs to be available for both control room dispatchers and cyber security analysts to maintain situation awareness of cyber security to effectively monitor the cyber assets on utility control systems. The researchers interviewed and observed control room dispatchers and spoke with regional control system engineers and cyber security analysts to define the context in which such information would be used. The results of this work will inform the design of a tool that will enhance cyber situation awareness and help facilitate effective communication between the various roles and organizations with utility and other regional authorities during contingencies. Index Terms—

24 POWER TRANSMISSION AND DISTRIBUTION↗

NASA NTRS1989

Space vehicle thermal testing: Principles, practices and effectiveness

Component qualification and acceptance temperatures are derived from worst case thermal analyses and analytic uncertainty margin subject to certain specified temperature extremes. Temperature requirements are shown for equipment operation within specification and for survival and turn-on (need not operate within specification, but must not experience any degradation when returned to operational range). Temperature excursions for most equipment are seen to be 20 to 50 C above and below room temperature. Components without active electronics which are mounted outboard, such as solar arrays and antennas, are usually designed to withstand wider temperature excursions, particularly at the cold end. Batteries are tightly controlled at cold temperatures to increase life. Payload components such as extremely accurate clocks for precise navigation are controlled over a relatively narrow temperature range.

Gluck, Donald F.↗

NASA NTRS1992

Development of magnetostrictive active members for control of space structures

The goal of this Phase 2 Small Business Innovative Research (SBIR) project was to determine the technical feasibility of developing magnetostrictive active members for use as truss elements in space structures. Active members control elastic vibrations of truss-based space structures and integrate the functions of truss structure element, actively controlled actuator, and sensor. The active members must control structural motion to the sub-micron level and, for many proposed space applications, work at cryogenic temperatures. Under this program both room temperature and cryogenic temperature magnetostrictive active members were designed, fabricated, and tested. The results of these performance tests indicated that room temperature magnetostrictive actuators feature higher strain, stiffness, and force capability with lower amplifier requirements than similarly sized piezoelectric or electrostrictive active members, at the cost of higher mass. Two different cryogenic temperature magnetostrictive materials were tested at liquid nitrogen temperatures, both with larger strain capability than the room temperature magnetostrictive materials. The cryogenic active member development included the design and fabrication of a cryostat that allows operation of the cryogenic active member in a space structure testbed.

Johnson, Bruce G.↗

DOE OSTI2024

End-Use Savings Shapes Measure Documentation: Demand Control Ventilation

This documentation focuses on a single end-use savings shape measure - Demand Control Ventilation (DCV). DCV can save energy by reducing the rate at which outdoor air (OA) is delivered during periods of less-than-design occupancy. This measure will enable DCV for air loops using applicable HVAC system types (all except dedicated outdoor air systems [DOAS], packaged systems, or that have an energy recovery ventilator [ERV]) and serving applicable space types (all except kitchens, dining areas, patient spaces, mechanical rooms, stairwells and corridors, or high exhaust space types) using model occupancy schedules to control the DCV. The measure is applicable to 72.7% of the stock floor area. As office buildings outside of California in ComStock are modeled using a single, whole-building space type, DCV is not applied to these building types. The DCV measure demonstrates 2.6% total site energy savings (119 trillion British thermal units [TBtu]) for the U.S. commercial building stock modeled in ComStock.

32 ENERGY CONSERVATION, CONSUMPTION, AND UTILIZATI↗

DOE OSTI2018

Lessons Learned from Performing a Human Factors Engineering Validation of an Upgraded Digital Control System in a Nuclear Power Plant Control Room

The United States' fleet of nuclear power plants (NPPs) have exceeded their original 40-year licenses and many are seeking license renewals to continue operations into the future. To support continued operation the Department of Energy's (DOE) Light Water Reactor Sustainability Program (LWRS) provides support for utilities to maintain and upgrade their power production capabilities. Control room modernization is one focus area, which aims to modernization the analog control rooms with digital controls and human-system interfaces (HSIs). The Turbine Control System (TCS) is a non-safety related system undergoing modernization efforts at multiple plants and utilities. Considerable human factors research efforts, comprised of expert reviews and operator in the loop studies were performed to develop human factors compliant and usable TCS. This report documents the final phase of the human factors engineering program used to design and validate the new digital TCS. According to the NUREG-0711 review guide, one of the last steps of human factors engineering program prior to implementation is human factors validation. This report details the method, results and conclusions from the human factors validation study of a collaborating utilities TCS slated to be implemented in one of their plants. One control room team consisting of two control room supervisors and two reactor operators participated in the validation. All team members had participated in the BNP TCS training program foregoing the TCS validation. Performance measures included task performance, situation awareness and workload, expert observation of any negative influences of human-system interface features on control room team performance, and interviews with the participating operators. Performance criteria were based on the performance scores and the topics identified by interviews and expert observations. The results showed that the crew using the new TCS clearly could achieve their overall objectives in the test scenarios with sufficient situation awareness. The new TCS compared to the old system provided clear improvements of the control room work regarding shell and chest warming and regarding valve and other system testing. However, a number of Human Engineering Discrepancies (HEDs) were identified. HEDs were prioritized (level 1, 2 or 3) according to potential safety, plant availability, operability or personnel performance consequences. Since no priority 1 HEDs were identified there is no HFE reason not to continue implementation of the TCS. The TCS upgrade is acceptable if the Priority 2 HEDs are resolved and dispositioned in a satisfactory way. Priority 3 HEDs should be noted and considered for future modifications.

21 SPECIFIC NUCLEAR REACTORS AND ASSOCIATED PLANTS↗

DOE OSTI2018

Processing Parameter Control of Lifetime-Limiting Failure Mechanisms in Al-Si Cast Alloys at Room and Elevated Temperatures

Aluminum-silicon cast alloys widely used throughout the transportation sector, A356, 319, and A390, have been studied with respect to chemical compositions and processing parameters that control the resultant mechanical behavior. First, the development of strengthening mechanisms is discussed in terms of the role that alloying elements, solidification behavior, and thermal treatments play. Based on this understanding, an extensive matrix of material conditions was developed and characterized in order to provide practical guidelines for alloy development. In order to provide an understanding of lifetime-limiting failure mechanisms, fatigue crack growth and hot compressive dwell behaviors were further investigated. Fatigue crack growth tests were conducted for all alloys at R = 0.1 and room temperature, and creep–fatigue of 319 was studied at R = − 1.5 and 250 °C. The role of processing parameters in controlling the mechanical properties is identified and discussed, and recommendations for optimized design are made.

36 MATERIALS SCIENCE↗

DOE OSTI2020

Role of Fast Dynamics in Conductivity of Polymerized Ionic Liquids

Polymerized ionic liquids (PolyILs) are promising candidates for a broad range of technologies. However, the relatively low conductivity of PolyILs at room temperature has strongly limited their applications. In this work, we provide new insights into the roles of various microscopic parameters controlling ion transport in these polymers, which are crucial for their rational design and practical applications. Using broadband dielectric spectroscopy and neutron and light scattering techniques, we found a clear connection between the activation energy for conductivity, fast dynamics, and high-frequency shear modulus in PolyILs at their glass transition temperature (T g ). In particular, our analysis reveals a correlation between conductivity and the amplitude of fast picosecond fluctuations at T g , suggesting the possible involvement of fast dynamics in lowering the energy barrier for ion conductivity. We also demonstrate that both the activation energy for ion transport and the amplitude of the fast fluctuations depend on the high-frequency shear moduli of PolyILs, thus identifying a practically important parameter for tuning conductivity. Finally, the parameters recognized in this work and their connection to the ionic conductivity of PolyILs set the stage for a deeper understanding of the mechanism of ion transport in PolyILs in the glassy state.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗

NASA NTRS1991

Man-machine interfaces in health care

The surgeon, like the pilot, is confronted with an ever increasing volume of voice, data, and image input. Simultaneously, the surgeon must control a rapidly growing number of devices to deliver care to the patient. The broad disciplines of man-machine interface design, systems integration, and teleoperation will play a role in the operating room of the future. The purpose of this communication is to report the incorporation of these design concepts into new surgical and laser delivery systems. A review of each general problem area and the systems under development to solve the problems are presented.

Charles, Steve↗

NASA NTRS1977

Toll-Booth Purification

NASA's Technology Application Team at Stanford Research Institute searched available information and suggested a transfer of clean-room technology employing the use of the same laminar flow techniques found in environmental control systems of clean rooms used for contamination-free assembly of precision aerospace equipment. That information, from technology originally developed by NASA and the Energy Research & Development Administration was incorporated in the design of a prototype toll booth purifier. The draft-free design includes a "diffusor", which blows clean air out the toll booth doorway, thus retarding the infiltration of contaminated air. The net effect is a decrease in the toll collector's inhalation of exhaust fumes. The Washington Department of Highways installed the prototype system in a toll booth at the Evergreen Point Bridge near Seattle. After a successful two-year test, the department now has equipped all 10 of the bridge's toll booths with the air purifiers.

Source record↗

DOE OSTI2023

Dyes in dye aggregate systems—engineering J, K, and dye packing

The present disclosure is directed to designing dyes and methods to alter the parameters controlling the dipole-dipole coupling of dyes bound to a nucleotide oligomer architecture, which are used to propagate excitons for use in next generation room temperature quantum information systems. The disclosed dyes and methods are directed to changing the dye stability, symmetry, overlap, and steric hindrance of the dyes to fine tune aggregate systems.

Knowlton, William B.↗

DOE OSTI2021

Dynamic Human-in-the-Loop Simulated Nuclear Power Plant Thermal Dispatch System Demonstration and Evaluation Study

An Idaho National Laboratory research team performed a human-in-the-loop study with two formerly licensed retired operators to evaluate thermal power dispatch operations supported by the modified GSE Systems GPWR plant simulator. Virtual representations of the analog control panels were presented on touch-screen bays configured to mimic the control room layout in the newly renovated Human Systems Simulation Laboratory. The operators performed 15 scenarios covering normal evolutions to transition the plant from full turbine operation to joint turbine and thermal power dispatch operations in addition to transient response scenarios induced with simulated faults to evaluate the impact of thermal power dispatch system on operator and plant responses. A prototype human-system interface (HSI) was developed and displayed in tandem with the virtual analog panels to support the operators executing the procedurally drive evolutions and transient responses. An interdisciplinary team of operations experts, nuclear engineers, and human factors experts observed the operators performing the scenarios to evaluate the operations. Only a preliminary analysis of the results has been performed. The full analysis will be shared in a milestone report scheduled for release at the end of September; however, some high-level conclusions were readily available. Two high level findings for the system design were captured in the study. The manual control supported by the HSI to transition from standard operations to thermal power dispatch operation imposed a considerable amount of workload on the operators due to tedious manual valve manipulations and system monitoring required to verify their intended effect. An additional operator would be required in the control room to support the daily evolution. Automatic control for the transition was deemed a requirement for plant adoption without imposing additional staffing costs. The second finding was the necessity for an automatic thermal power dispatch system trip isolation function linked to a turbine and reactor trip signal. The operators completed scenarios with automatic isolation functionality and manually required actuation of the thermal power dispatch system. The operator response was sufficiently slower in the manual trip condition, such that operators were unable to manually actuate key post trip safety functions an indicate a degraded control capability that should be avoided. With an automatic trip signal little to no impact of the thermal power dispatch system was identified on the primary plant response and therefore the system could be readily and safely adopted. Together these two findings represent the need to support the adoption of thermal power dispatch capability into existing operations by leveraging automation to augment any additional operator tasking required to control and monitor an additional system beyond existing operations.

99 GENERAL AND MISCELLANEOUS↗

DOE OSTI2016

A Section 106 Evaluation of Building CP-1, Area 6, Nevada National Security Site, Nye County, Nevada

On December 17, 2015, the National Nuclear Security Administration Nevada Field Office (NNSA/NFO) vacated Building CP-1 (Building 06-CP-1) on the Nevada National Security Site (NNSS) in Nye County, Nevada. Starting in 1951, nearly all nuclear tests during the Cold War were controlled from this building on the facility, known as the Nevada Test Site for most of its years of operation. The test site was renamed the NNSS in 2010. CP-1 was the command and control center where decisions about NNSS activities were sought and made; where authorization for movements about the areas forward (north) of Mercury base camp were coordinated, granted or declined, and monitored; and where problems and emergencies in the forward areas were communicated and relayed to the appropriate agencies for solution. Some of the testing duties for the Control Point included the timing and firing of nuclear tests, air operations, security, communications, weather monitoring, and radiation safety. During tests, communications were maintained through various channels to receive and pass instructions or information to the numerous testing operations, to Washington, D.C., the national laboratories, and overhead aircraft monitoring the tests. At one time, the Security Control Center, a Class A Weather Station, and the Radiation Safety Headquarters were located in CP-1, which also contained a cafeteria, a dining area, and bunk rooms. This survey was prompted by recognition that closure of the building in place creates a situation where CP-1 is vulnerable to decay in its present and unused condition. Activities at CP-1 have been reduced gradually over time since the end of nuclear testing in 1992. The Area of Potential Effects (APE) was determined by NNSA/NFO to be a two-acre area historically considered the space directly associated with CP-1 and available to CP-1 personnel for use. The APE is bounded on the south by an unnamed main paved road into the guarded Control Point area, on the west by the edge of the parking lot for adjacent Building CP-9, on the east by the edge of the bladed cut-and-fill terrace for CP-1, and on the north by a barbed wire security fence (Figure 2). All of this lot is either bladed or covered with asphalt. Contained within the lot are eight Accessary Resources (AR) which are much more closely aligned with CP-1 than with adjacent buildings. AR are defined by the Nevada State Historic Preservation Office (SHPO) (2013) as “…related but subordinate to the principal building. Accessory resources would not exist were it not for the principal resource.” The Visual APE was determined by NNSA/NFO to be the same as the APE used for intensive survey because no exterior modifications to the resource are anticipated. The APE is located in Section 34 T11S R53E MDBM (projected) within the NNSS base called the Control Point in Area 6. It is on the 1986 Yucca Lake USGS 7.5 min. series topographic quadrangle. The Desert Research Institute (DRI) surveyed the APE with the assistance of National Security Technologies, LLC (NSTec), resulting in recordation and evaluation of CP-1 (SHPO Resource Number B14490) and eight accessory resources (AR1-AR8). This recording of CP-1 was done in three sessions. Copies of the building form and report are on file at Nevada Cultural Resources Information System (NVCRIS), DRI, and with the NNSA/NFO, Las Vegas, Nevada. Control Point refers to the support facilities of which Building CP-1, with its 126 rooms, is the most important part (Campbell et al. 1983:165). CP-1 refers to the entire building but it also is the designation for the first phase of construction, i.e. the original building. There were three major subsequent phases of additions to the building. The first two were called CP-1A (the east wing) and CP-1B (the west wing with the new War Room). A final phase filled in the hyphen between CP-1 and CP-1B with a Field Office. For convenience this last phase is called CP-1C in this report. Hence, CP-1 can refer either the entire building or to the first phase of the building exclusive of additions. The context makes clear which of the two meanings is intended in the various sections of this report. There were also two minor expansions consisting of a small battery room and a shelter for an emergency exit.

54 ENVIRONMENTAL SCIENCES↗

DOE OSTI2016

Multifunctional BiFeO{sub 3}/TiO{sub 2} nano-heterostructure: Photo-ferroelectricity, rectifying transport, and nonvolatile resistive switching property

Multifunctional BiFeO{sub 3} nanostructure anchored TiO{sub 2} nanotubes are fabricated by coupling wet chemical and electrochemical routes. BiFeO{sub 3}/TiO{sub 2} nano-heterostructure exhibits white-light-induced ferroelectricity at room temperature. Studies reveal that the photogenerated electrons trapped at the domain/grain boundaries tune the ferroelectric polarization in BiFeO{sub 3} nanostructures. The photon controlled saturation and remnant polarization opens up the possibility to design ferroelectric devices based on BiFeO{sub 3.} The nano-heterostructure also exhibits substantial photovoltaic effect and rectifying characteristics. Photovoltaic property is found to be correlated with the ferroelectric polarization. Furthermore, the nonvolatile resistive switching in BiFeO{sub 3}/TiO{sub 2} nano-heterostructure has been studied, which demonstrates that the observed resistive switching is most likely caused by the electric-field-induced carrier injection/migration and trapping/detrapping process at the hetero-interfaces. Therefore, BiFeO{sub 3}/TiO{sub 2} nano-heterostructure coupled with logic, photovoltaics and memory characteristics holds promises for long-term technological applications in nanoelectronics devices.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

DOE OSTI2014

Application of E{sub h}-pH diagram for room temperature precipitation of zinc stannate microcubes in an aqueous media

Graphical abstract: - Highlights: • One pot aqueous synthesis of zinc stannate (ZnSnO{sub 3}) particles at low temperature. • Synthesis designed with the assistance of potential-pH diagram. • ZnSnO{sub 3} estimated to be stable between pH 8 and 12 was used for synthesis of the particles. • ZnSnO{sub 3}·3H{sub 2}O were formed during the precipitation of zinc stannate. - Abstract: Potential-pH diagram assisted-design for controlled precipitation is an attractive method to obtain engineered binary and ternary oxide particles. Aqueous synthesis conditions of zinc stannate (ZnSnO{sub 3}) particles at low temperature were formulated with the assistance of potential-pH diagram. The pH of a solution containing stoichiometric amounts of Zn{sup 2+} and Sn{sup 4+} was controlled for the precipitation in a one pot synthesis step at room temperature (25 °C). The effect of the concentration of the reactants on the particle size was studied by varying the concentration of the precursor (Zn{sup 2+} + Sn{sup 4+}) solution. Scanning electron micrographs show that the particles are monodispersed micron sized cubes formed by the self-organization of nano-sized crystallites. The obtained microcubes characterized by X-ray Diffraction and thermo gravimetric analysis (TGA) show that the particles are in ZnSnO{sub 3}·3H{sub 2}O form.

36 MATERIALS SCIENCE↗

NASA NTRSDate not supplied

Clean is not Sterile: A Planetary Science and Planetary Protection Perspective on Cleanroom Microbiology at NASA

The Astromaterials Acquisition and Curation Office at NASA is responsible for the curation of extraterrestrial samples from NASA’s past and future sample return missions. Our office curates samples from the moon, meteorites, comets, asteroids, cosmic dust and solar wind particles. All these samples are kept in cleanrooms to limit particulate and trace metal contamination, but none of these cleanrooms are specifically designed to control microbial contamination. During the early Apollo missions NASA scientists were very concerned with protecting the Earth from potential microbial contamination from the moon and with protecting the lunar samples from terrestrial microbes. NASA developed specialized equipment and clean rooms to keep these collections pristine. However, as we learned more about the lunar environment our concerns about microbial contamination lessened. Today none of the existing collections have microbial contamination requirements because they are not considered susceptible to microbial alteration under curation conditions (e.g. solar wind samples, and lunar samples) or have already been contaminated by terrestrial biology (meteorites collected in Antarctica). However, NASA’s OSIRIS-REx mission will land in 2023 with samples from a carbon rich asteroid that will be susceptible to microbial alteration. The Perseverance rover on Mars will begin to collect and cache samples that will be returned to Earth as soon as 2031. Martian samples may contain signs of extraterrestrial life and will have to be treated like the early Apollo samples. Martian samples will be isolated to protect the Earth, and must also be protected from terrestrial contamination. I will present microbial monitoring data from existing NASA cleanrooms and discuss how NASA is planning to use techniques from the pharmaceutical industry and academia to design new laboratories and equipment that will protect astromaterials and the earth from unwanted microbial contamination. I will also discuss a project to sample the external microbiome of the International Space Station. Results from this research will be used to design facilities for use on Mars that limit the amount of contamination associated with crewed missions.

Aaron B Regberg↗

DOE OSTI2017

Operating displays - new concept: high performance displays - 118

New control rooms in Nuclear Power Plants using digital Distributed Control System (DCS) operated with software displays, are providing thousands of signals to the operating crew. When an event happens, the Flood of information provided to operators could obscure the initiator event increasing the operator response time, work load and complicating the selection of the actions to be performed. There are some initiatives that are trying to minimize the 'avalanche effect' as the alarm engineering filtering and prioritization or diagnostic displays. Likewise, new control rooms are lost the availability to know the plant status just with a quick glance to the panel indicators. Regarding Small Modular Reactors, where in some cases four operators should monitor and control twelve reactors, these problems are even more significant. The challenge is to find a solution, based on current digital systems, that supply information to operators in order to prevent events and take early actions to minimize or avoid any unexpected incident. In order to minimize human errors, Tecnatom has developed a specific set of displays, called 'High Performance Displays' (HPD) based on objectives, work environment limitation, and non-anticipated events. These displays are being design following the HFE standards: applying the NUREG-0711 elements to identify the information that they have to content and the NUREG-0700 to design the interface. The function of these displays is monitoring the plant situation in a way that the operators are able to recognize any potential event at a simple glance but controlling thousands of signals through pattern recognition, symmetries, regular polygons and colors. The objective of the HPD is to provide an integrated function minimizing the tunnel effect and reduce the workload during the diagnosis phase. Moreover, HPD enhance operators to take the right actions to anticipate the response to any event, even avoiding it, if possible This paper analyzes how HPD's have been design as well as presents the results of a preliminary validation of their capabilities. The preliminary validation is a reduce validation in a full scope simulator running two representative scenarios of abnormal and emergency operation. The analysis is focused on the first stage of the event, i.e. the detection phase, HPD's have been installed in a generic full scope simulator of a nuclear power plant, digital controlled. Both scenarios have been performed by two different operator crews. The first operator shift has worked with the conventional human machine interface, that is, displays similar to the ones currently installed in existing nuclear power plant with digital control. The second crew, reproduce the same scenarios but with HPD available. The studio collects preliminary data in order to compare results, draw lesson learned from the experience to improve HPD design, and find solutions in terms of reducing human errors, human workload, and increase the availability of the plant. (authors)

22 GENERAL STUDIES OF NUCLEAR REACTORS↗

NASA NTRS1982

Human factors dimensions in the evolution of increasingly automated control rooms for near-earth satellites

The NASA-Goddard Space Flight Center is responsible for the control and ground support for all of NASA's unmanned near-earth satellites. Traditionally, each satellite had its own dedicated mission operations room. In the mid-seventies, an integration of some of these dedicated facilities was begun with the primary objective to reduce costs. In this connection, the Multi-Satellite Operations Control Center (MSOCC) was designed. MSOCC represents currently a labor intensive operation. Recently, Goddard has become increasingly aware of human factors and human-machine interface issues. A summary is provided of some of the attempts to apply human factors considerations in the design of command and control environments. Current and future activities with respect to human factors and systems design are discussed, giving attention to the allocation of tasks between human and computer, and the interface for the human-computer dialogue.

Mitchell, C. M.↗