Source code for pybamm.experiments.experiment

#
# Experiment class
#

import numpy as np
import re


examples = """

    "Discharge at 1C for 0.5 hours at 27oC",
    "Discharge at C/20 for 0.5 hours at 29oC",
    "Charge at 0.5 C for 45 minutes at -5oC",
    "Discharge at 1 A for 0.5 hours at -5.1oC",
    "Charge at 200 mA for 45 minutes at 10.2oC (1 minute period)",
    "Discharge at 1W for 0.5 hours at -10.4oC",
    "Charge at 200mW for 45 minutes",
    "Rest for 10 minutes (5 minute period)",
    "Hold at 1V for 20 seconds",
    "Charge at 1 C until 4.1V",
    "Hold at 4.1 V until 50mA",
    "Hold at 3V until C/50",
    "Discharge at C/3 for 2 hours or until 2.5 V at 26oC",
    "Run US06 (A) at -5oC",
    "Run US06 (V) for 5 minutes",
    "Run US06 (W) for 0.5 hours",

    """


[docs]class Experiment: """ Base class for experimental conditions under which to run the model. In general, a list of operating conditions should be passed in. Each operating condition should be of the form "Do this for this long" or "Do this until this happens". For example, "Charge at 1 C for 1 hour", or "Charge at 1 C until 4.2 V", or "Charge at 1 C for 1 hour or until 4.2 V at 25oC". The instructions can be of the form "(Dis)charge at x A/C/W", "Rest", or "Hold at x V until y A at z oC". The running time should be a time in seconds, minutes or hours, e.g. "10 seconds", "3 minutes" or "1 hour". The stopping conditions should be a circuit state, e.g. "1 A", "C/50" or "3 V". The parameter drive_cycles is mandatory to run drive cycle. For example, "Run x", then x must be the key of drive_cycles dictionary. The temperature should be provided after the stopping condition but before the period, e.g. "1 A at 25 oC (1 second period)". It is not essential to provide a temperature and a global temperature can be set either from within the paramter values of passing a temperature to this experiment class. If the temperature is not specified in a line, then the global temperature is used, even if another temperature has been set in an earlier line. Parameters ---------- operating_conditions : list List of operating conditions period : string, optional Period (1/frequency) at which to record outputs. Default is 1 minute. Can be overwritten by individual operating conditions. temperature: float, optional The ambient air temperature in degrees Celsius at which to run the experiment. Default is None whereby the ambient temperature is taken from the parameter set. This value is overwritten if the temperature is specified in a step. termination : list, optional List of conditions under which to terminate the experiment. Default is None. drive_cycles : dict Dictionary of drive cycles to use for this experiment. cccv_handling : str, optional How to handle CCCV. If "two-step" (default), then the experiment is run in two steps (CC then CV). If "ode", then the experiment is run in a single step using an ODE for current: see :class:`pybamm.external_circuit.CCCVFunctionControl` for details. """ def __init__( self, operating_conditions, period="1 minute", temperature=None, termination=None, drive_cycles={}, cccv_handling="two-step", ): if cccv_handling not in ["two-step", "ode"]: raise ValueError("cccv_handling should be either 'two-step' or 'ode'") self.cccv_handling = cccv_handling # Save arguments for copying self.args = ( operating_conditions, period, temperature, termination, drive_cycles, cccv_handling, ) self.period = self.convert_time_to_seconds(period.split()) self.temperature = temperature operating_conditions_cycles = [] for cycle in operating_conditions: # Check types and convert strings to 1-tuples if (isinstance(cycle, tuple) or isinstance(cycle, str)) and all( [isinstance(cond, str) for cond in cycle] ): if isinstance(cycle, str): processed_cycle = (cycle,) else: processed_cycle = [] idx = 0 finished = False while not finished: step = cycle[idx] if idx < len(cycle) - 1: next_step = cycle[idx + 1] else: next_step = None finished = True if self.is_cccv(step, next_step): processed_cycle.append( f"{step} then {next_step[0].lower()}{next_step[1:]}" ) idx += 2 else: processed_cycle.append(step) idx += 1 if idx >= len(cycle): finished = True operating_conditions_cycles.append(tuple(processed_cycle)) else: try: # Condition is not a string badly_typed_conditions = [ cond for cond in cycle if not isinstance(cond, str) ] except TypeError: # Cycle is not a tuple or string badly_typed_conditions = [] badly_typed_conditions = badly_typed_conditions or [cycle] raise TypeError( "Operating conditions should be strings or tuples of strings, not " f"{type(badly_typed_conditions[0])}. For example: {examples}" ) self.cycle_lengths = [len(cycle) for cycle in operating_conditions_cycles] operating_conditions = [ cond for cycle in operating_conditions_cycles for cond in cycle ] self.operating_conditions_cycles = operating_conditions_cycles self.operating_conditions_strings = operating_conditions self.operating_conditions = [ self.read_string(cond, drive_cycles) for cond in operating_conditions ] self.termination_string = termination self.termination = self.read_termination(termination) def __str__(self): return str(self.operating_conditions_cycles) def copy(self): return Experiment(*self.args) def __repr__(self): return "pybamm.Experiment({!s})".format(self)
[docs] def read_string(self, cond, drive_cycles): """ Convert a string to a dictionary of the right format Parameters ---------- cond : str String of appropriate form for example "Charge at x C for y hours". x and y must be numbers, 'C' denotes the unit of the external circuit (can be A for current, C for C-rate, V for voltage or W for power), and 'hours' denotes the unit of time (can be second(s), minute(s) or hour(s)) drive_cycles: dict A map specifying the drive cycles """ if " then " in cond: # If the string contains " then ", then this is a two-step CCCV experiment # and we need to split it into two strings cond_CC, cond_CV = cond.split(" then ") op_CC = self.read_string(cond_CC, drive_cycles) op_CV = self.read_string(cond_CV, drive_cycles) if op_CC["temperature"] != op_CV["temperature"]: raise ValueError( "The temperature for the CC and CV steps must be the same." f"Got {op_CC['temperature']} and {op_CV['temperature']}" f"from {op_CC['string']} and {op_CV['string']}" ) tag_CC = op_CC["tags"] or [] tag_CV = op_CV["tags"] or [] tags = list(np.unique(tag_CC + tag_CV)) if len(tags) == 0: tags = None outputs = { "type": "CCCV", "Voltage input [V]": op_CV["Voltage input [V]"], "time": op_CV["time"], "period": op_CV["period"], "temperature": op_CC["temperature"], "dc_data": None, "string": cond, "events": op_CV["events"], "tags": tags, } if "Current input [A]" in op_CC: outputs["Current input [A]"] = op_CC["Current input [A]"] else: outputs["C-rate input [-]"] = op_CC["C-rate input [-]"] return outputs # Read tags if " [" in cond: cond, tag_str = cond.split(" [") tags = tag_str[0:-1].split(",") else: tags = None # Read period if " period)" in cond: cond, time_period = cond.split(" (") time, _ = time_period.split(" period)") period = self.convert_time_to_seconds(time.split()) else: period = self.period # Temperature part of the condition is removed here unprocessed_cond = cond temperature, cond = self._read_and_drop_temperature(cond) # Read instructions if "Run" in cond: cond_list = cond.split() if "at" in cond: raise ValueError(f"Instruction must be of the form: {examples}") dc_types = ["(A)", "(V)", "(W)"] if all(x not in cond for x in dc_types): raise ValueError( "Type of drive cycle must be specified using '(A)', '(V)' or '(W)'." f" For example: {examples}" ) else: dc_data = drive_cycles[cond_list[1]] # Check for Events if "for" in cond: # e.g. for 3 hours idx = cond_list.index("for") end_time = self.convert_time_to_seconds(cond_list[idx + 1 :]) ext_drive_cycle = self.extend_drive_cycle(dc_data, end_time) # Drive cycle as numpy array dc_data = ext_drive_cycle # Set time and period to 1 second for first step and # then calculate the difference in consecutive time steps time = dc_data[:, 0][-1] period = np.min(np.diff(dc_data[:, 0])) # Find the unit of drive cycle ("A", "V", or "W") unit = cond_list[2][1] electric = {"dc_data": dc_data, "unit": unit} events = None else: dc_data = None if "for" in cond and "or until" in cond: # e.g. for 3 hours or until 4.2 V cond_list = cond.split() idx_for = cond_list.index("for") idx_until = cond_list.index("or") electric = self.convert_electric(cond_list[:idx_for]) time = self.convert_time_to_seconds(cond_list[idx_for + 1 : idx_until]) events = self.convert_electric(cond_list[idx_until + 2 :]) elif "for" in cond: # e.g. for 3 hours cond_list = cond.split() idx = cond_list.index("for") electric = self.convert_electric(cond_list[:idx]) time = self.convert_time_to_seconds(cond_list[idx + 1 :]) events = None elif "until" in cond: # e.g. until 4.2 V cond_list = cond.split() idx = cond_list.index("until") electric = self.convert_electric(cond_list[:idx]) time = None events = self.convert_electric(cond_list[idx + 1 :]) else: raise ValueError( "Operating conditions must contain keyword 'for' or 'until' or " f"'Run'. For example: {examples}" ) self.unit_to_type(electric) self.unit_to_type(events) return { **electric, "time": time, "period": period, "temperature": temperature, "dc_data": dc_data, "string": unprocessed_cond, "events": events, "tags": tags, }
def unit_to_type(self, electric): if electric is not None: unit = electric.pop("unit") if unit == "C": electric["type"] = "C-rate" elif unit == "A": electric["type"] = "current" elif unit == "V": electric["type"] = "voltage" elif unit == "W": electric["type"] = "power" return electric
[docs] def extend_drive_cycle(self, drive_cycle, end_time): "Extends the drive cycle to enable for event" temp_time = [] temp_time.append(drive_cycle[:, 0]) loop_end_time = temp_time[0][-1] i = 1 while loop_end_time <= end_time: # Extend the drive cycle until the drive cycle time # becomes greater than specified end time temp_time.append( np.append(temp_time[i - 1], temp_time[0] + temp_time[i - 1][-1] + 1) ) loop_end_time = temp_time[i][-1] i += 1 time = temp_time[-1] drive_data = np.tile(drive_cycle[:, 1], i) # Combine the drive cycle time and data ext_drive_cycle = np.column_stack((time, drive_data)) # Limit the drive cycle to the specified end_time ext_drive_cycle = ext_drive_cycle[ext_drive_cycle[:, 0] <= end_time] del temp_time return ext_drive_cycle
[docs] def convert_electric(self, electric): """Convert electrical instructions to consistent output""" # Rest == zero current if electric[0].lower() == "rest": return {"Current input [A]": 0, "unit": "A"} else: if len(electric) in [3, 4]: if len(electric) == 4: # e.g. Charge at 4 A, Hold at 3 V instruction, _, value, unit = electric value_unit = value + unit elif len(electric) == 3: # e.g. Discharge at C/2, Charge at 1A instruction, _, value_unit = electric # Read instruction if instruction.lower() in ["discharge", "hold"]: sign = 1 elif instruction.lower() == "charge": sign = -1 else: raise ValueError( "Instruction must be 'discharge', 'charge', 'rest', 'hold' or " f"'Run'. For example: {examples}" "" "The following instruction does not comply: " f"{instruction}" ) elif len(electric) == 2: # e.g. 3 A, 4.1 V value, unit = electric value_unit = value + unit sign = 1 elif len(electric) == 1: # e.g. C/2, 1A value_unit = electric[0] sign = 1 else: raise ValueError( """Instruction '{}' not recognized. Some acceptable examples are: {} """.format( " ".join(electric), examples ) ) # e.g. C/2, 1A if value_unit[0] == "C": # e.g. C/2 unit = value_unit[0] value = 1 / float(value_unit[2:]) else: unit = value_unit[-1:] if "m" in value_unit: # e.g. 1mA value = float(value_unit[:-2]) / 1000 else: # e.g. 1A value = float(value_unit[:-1]) # Read value and units if unit == "C": return {"C-rate input [-]": sign * float(value), "unit": unit} elif unit == "A": return {"Current input [A]": sign * float(value), "unit": unit} elif unit == "V": return {"Voltage input [V]": float(value), "unit": unit} elif unit == "W": return {"Power input [W]": sign * float(value), "unit": unit} else: raise ValueError( """units must be 'C', 'A', 'mA', 'V', 'W' or 'mW', not '{}'. For example: {} """.format( unit, examples ) )
def _read_and_drop_temperature(self, cond): matches = re.findall(r"at\s-*\d+\.*\d*\s*oC", cond) if len(matches) == 0: if "oC" in cond: raise ValueError(f"Temperature not written correctly on step: '{cond}'") temperature = self.temperature reduced_cond = cond elif len(matches) == 1: match = matches[0] numerical_part = re.findall(r"-*\d+\.*\d*", match)[0] temperature = float(numerical_part) reduced_cond = cond.replace(match, "") else: raise ValueError(f"More than one temperature found on step: '{cond}'") return temperature, reduced_cond
[docs] def convert_time_to_seconds(self, time_and_units): """Convert a time in seconds, minutes or hours to a time in seconds""" time, units = time_and_units if units in ["second", "seconds", "s", "sec"]: time_in_seconds = float(time) elif units in ["minute", "minutes", "m", "min"]: time_in_seconds = float(time) * 60 elif units in ["hour", "hours", "h", "hr"]: time_in_seconds = float(time) * 3600 else: raise ValueError( """time units must be 'seconds', 'minutes' or 'hours'. For example: {} """.format( examples ) ) return time_in_seconds
[docs] def read_termination(self, termination): """ Read the termination reason. If this condition is hit, the experiment will stop. """ if termination is None: return {} elif isinstance(termination, str): termination = [termination] termination_dict = {} for term in termination: term_list = term.split() if term_list[-1] == "capacity": end_discharge = "".join(term_list[:-1]) if end_discharge.endswith("%"): end_discharge_percent = end_discharge.split("%")[0] termination_dict["capacity"] = (float(end_discharge_percent), "%") elif end_discharge.endswith("Ah"): end_discharge_Ah = end_discharge.split("Ah")[0] termination_dict["capacity"] = (float(end_discharge_Ah), "Ah") elif end_discharge.endswith("A.h"): end_discharge_Ah = end_discharge.split("A.h")[0] termination_dict["capacity"] = (float(end_discharge_Ah), "Ah") else: raise ValueError( "Capacity termination must be given in the form " "'80%', '4Ah', or '4A.h'" ) elif term.endswith("V"): end_discharge_V = term.split("V")[0] termination_dict["voltage"] = (float(end_discharge_V), "V") else: raise ValueError( "Only capacity or voltage can be provided as a termination reason, " "e.g. '80% capacity', '4 Ah capacity', or '2.5 V'" ) return termination_dict
[docs] def is_cccv(self, step, next_step): """ Check whether a step and the next step indicate a CCCV charge """ if self.cccv_handling == "two-step" or next_step is None: return False # e.g. step="Charge at 2.0 A until 4.2V" # next_step="Hold at 4.2V until C/50" if ( (step.startswith("Charge") or step.startswith("Discharge")) and "until" in step and "V" in step and "Hold at " in next_step and "V until" in next_step ): op = self.read_string(step, None) next_op = self.read_string(next_step, None) # Check that the event conditions are the same as the hold conditions if op["events"] == {k: v for k, v in next_op.items() if k in op["events"]}: return True return False
def search_tag(self, tag): cycles = [] for i, cycle in enumerate(self.operating_conditions_cycles): for cond in cycle: if " [" in cond: cond, tag_str = cond.split(" [") tags = tag_str[0:-1].split(",") if tag in tags: cycles.append(i) break return cycles