@mat3ra/made 2024.6.3-0 → 2024.6.4-0
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- package/dist/js/cell/cell.d.ts +3 -2
- package/dist/js/lattice/lattice.d.ts +1 -1
- package/dist/js/material.d.ts +3 -8
- package/dist/js/math.d.ts +2 -2
- package/dist/js/tools/material.js +3 -6
- package/dist/js/types.d.ts +1 -1
- package/package.json +4 -6
- package/src/js/cell/cell.ts +3 -3
- package/src/js/material.ts +1 -1
- package/src/js/{math.js → math.ts} +2 -2
- package/src/js/tools/material.js +1 -1
- package/src/js/types.ts +1 -1
package/dist/js/cell/cell.d.ts
CHANGED
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@@ -1,6 +1,7 @@
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1
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+
import CodeMath from "@mat3ra/code/dist/js/math";
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import { Coordinate } from "../basis/types";
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import { Vector, VectorsAsArray } from "../lattice/types";
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-
type Point = Coordinate |
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+
type Point = Coordinate | CodeMath.Matrix | CodeMath.MathType;
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export declare class Cell {
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tolerance: number;
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vector1: Vector;
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@@ -21,7 +22,7 @@ export declare class Cell {
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/**
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* Convert a point (in crystal coordinates) to cartesian.
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*/
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-
convertPointToCartesian(point: Point):
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convertPointToCartesian(point: Point): CodeMath.MathType;
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/**
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* Convert a point (in cartesian coordinates) to crystal (fractional).
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*/
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@@ -83,7 +83,7 @@ export declare class Lattice extends LatticeBravais implements LatticeSchema {
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beta: number;
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gamma: number;
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units: {
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-
length?: "
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length?: "angstrom" | "bohr" | undefined;
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angle?: "degree" | "radian" | undefined;
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};
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type: "CUB" | "BCC" | "FCC" | "TET" | "MCL" | "ORC" | "ORCC" | "ORCF" | "ORCI" | "HEX" | "BCT" | "TRI" | "MCLC" | "RHL";
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package/dist/js/material.d.ts
CHANGED
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@@ -1,5 +1,5 @@
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1
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import { HasConsistencyChecksHasMetadataNamedDefaultableInMemoryEntity } from "@mat3ra/code/dist/js/entity";
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-
import { AnyObject } from "@mat3ra/
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import { AnyObject } from "@mat3ra/esse/dist/js/esse/types";
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import { ConsistencyCheck, DerivedPropertiesSchema, FileSourceSchema, MaterialSchema } from "@mat3ra/esse/dist/js/types";
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import { ConstrainedBasis } from "./basis/constrained_basis";
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import { Constraint } from "./constraints/constraints";
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@@ -483,9 +483,7 @@ export declare const Material: {
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setProps(json?: AnyObject | undefined): any;
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toJSON(exclude?: string[] | undefined): AnyObject;
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toJSONSafe(exclude?: string[] | undefined): AnyObject;
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-
toJSONQuick(exclude?: string[] | undefined): AnyObject;
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* Returns a copy of the material with conventional cell constructed instead of primitive.
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-
*/
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toJSONQuick(exclude?: string[] | undefined): AnyObject;
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clone(extraContext?: object | undefined): any;
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validate(): void;
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clean(config: AnyObject): AnyObject;
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@@ -511,10 +509,7 @@ export declare const Material: {
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toJSONQuick(exclude?: string[] | undefined): AnyObject;
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clone(extraContext?: object | undefined): any;
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validate(): void;
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-
clean(config: AnyObject): AnyObject;
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* @summary a series of checks for the material's basis and returns an array of results in ConsistencyChecks format.
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* @returns Array of checks results
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-
*/
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clean(config: AnyObject): AnyObject;
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isValid(): boolean;
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id: string;
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readonly cls: string;
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package/dist/js/math.d.ts
CHANGED
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@@ -35,7 +35,7 @@ declare const _default: {
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uninitialized: any;
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version: string;
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expression: import("mathjs").MathNode;
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-
json: mathjs.MathJsJson;
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json: import("mathjs").MathJsJson;
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config: (options: any) => void;
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lsolve(L: import("mathjs").Matrix | import("mathjs").MathArray, b: import("mathjs").Matrix | import("mathjs").MathArray): import("mathjs").Matrix | import("mathjs").MathArray;
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lup(A?: import("mathjs").Matrix | import("mathjs").MathArray | undefined): import("mathjs").MathArray;
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@@ -184,7 +184,7 @@ declare const _default: {
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re(x: number | import("mathjs").Matrix | import("mathjs").BigNumber | import("mathjs").Complex | import("mathjs").MathArray): number | import("mathjs").Matrix | import("mathjs").BigNumber | import("mathjs").MathArray;
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bignumber(x?: string | number | boolean | import("mathjs").Matrix | import("mathjs").MathArray | undefined): import("mathjs").BigNumber;
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boolean(x: string | number | boolean | import("mathjs").Matrix | import("mathjs").MathArray): boolean | import("mathjs").Matrix | import("mathjs").MathArray;
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chain(value?: any):
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chain(value?: any): import("mathjs").MathJsChain;
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complex(arg?: string | import("mathjs").Complex | import("mathjs").MathArray | import("mathjs").PolarCoordinates | undefined): import("mathjs").Complex;
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complex(re: number, im: number): import("mathjs").Complex;
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fraction(numerator: string | number | import("mathjs").Matrix | import("mathjs").MathArray, denominator?: string | number | import("mathjs").Matrix | import("mathjs").MathArray | undefined): import("mathjs").Matrix | import("mathjs").Fraction | import("mathjs").MathArray;
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@@ -1,9 +1,6 @@
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"use strict";
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-
var __importDefault = (this && this.__importDefault) || function (mod) {
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return (mod && mod.__esModule) ? mod : { "default": mod };
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-
};
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Object.defineProperty(exports, "__esModule", { value: true });
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-
const
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const math_1 = require("@mat3ra/code/dist/js/math");
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const constants_1 = require("../constants");
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const lattice_1 = require("../lattice/lattice");
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/**
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@@ -40,8 +37,8 @@ function getBasisConfigTranslatedToCenter(material) {
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material.toCartesian();
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const updatedBasis = material.Basis;
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const centerOfCoordinates = updatedBasis.centerOfCoordinatesPoint;
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const centerOfLattice =
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const translationVector =
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const centerOfLattice = math_1.math.multiply(0.5, material.Lattice.vectorArrays.reduce((a, b) => math_1.math.add(a, b)));
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const translationVector = math_1.math.subtract(centerOfLattice, centerOfCoordinates);
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updatedBasis.translateByVector(translationVector);
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material.setBasis(updatedBasis.toJSON());
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if (originalUnits !== constants_1.ATOMIC_COORD_UNITS.cartesian)
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package/dist/js/types.d.ts
CHANGED
package/package.json
CHANGED
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@@ -1,6 +1,6 @@
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{
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"name": "@mat3ra/made",
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"version": "2024.6.
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"version": "2024.6.4-0",
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"description": "MAterials DEsign library",
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"scripts": {
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"lint": "eslint --cache src/js tests/js && prettier --write src/js tests/js",
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@@ -33,11 +33,10 @@
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"@babel/register": "^7.22.15",
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"@babel/runtime-corejs3": "^7.16.8",
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"@exabyte-io/eslint-config": "^2023.8.29-1",
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"@mat3ra/code": "2024.
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"@mat3ra/esse": "2024.
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"@mat3ra/tsconfig": "
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"@mat3ra/code": "2024.6.4-0",
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"@mat3ra/esse": "2024.6.4-1",
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"@mat3ra/tsconfig": "2024.6.3-0",
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"@types/crypto-js": "^4.2.2",
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"@types/mathjs": "^3.21.1",
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"@typescript-eslint/eslint-plugin": "^5.9.1",
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"@typescript-eslint/parser": "^5.9.1",
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"chai": "^4.3.4",
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@@ -72,7 +71,6 @@
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"array-almost-equal": "^1.0.0",
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"crypto-js": "4.2.0",
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"lodash": "^4.17.*",
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"mathjs": "12.4.1",
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"ts-node": "^10.9.1",
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"typescript": "^4.5.5",
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"underscore": "^1.8.3",
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package/src/js/cell/cell.ts
CHANGED
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@@ -1,4 +1,4 @@
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1
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import { math } from "@mat3ra/code/dist/js/math";
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import CodeMath, { math } from "@mat3ra/code/dist/js/math";
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import { Coordinate } from "../basis/types";
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import constants from "../constants";
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@@ -10,7 +10,7 @@ const INV = math.inv;
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// @ts-ignore
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const MATRIX_MULT = (...args) => MULT(...args.map((x) => MATRIX(x))).toArray();
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type Point = Coordinate |
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type Point = Coordinate | CodeMath.Matrix | CodeMath.MathType;
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/*
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* Cell represents a unit cell in geometrical form: 3x3 matrix where rows are cell vectors.
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@@ -64,7 +64,7 @@ export class Cell {
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/**
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* Convert a point (in crystal coordinates) to cartesian.
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*/
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convertPointToCartesian(point: Point) {
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convertPointToCartesian(point: Point): CodeMath.MathType {
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return MULT(point, this.vectorsAsArray);
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}
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package/src/js/material.ts
CHANGED
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@@ -1,5 +1,5 @@
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import { HasConsistencyChecksHasMetadataNamedDefaultableInMemoryEntity } from "@mat3ra/code/dist/js/entity";
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import { AnyObject } from "@mat3ra/
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import { AnyObject } from "@mat3ra/esse/dist/js/esse/types";
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import {
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ConsistencyCheck,
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DerivedPropertiesSchema,
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package/src/js/tools/material.js
CHANGED
package/src/js/types.ts
CHANGED