pypi.org "materials-project" keyword
mcta 0.0.2
Meta Crystal Toolkit & Analysis (mcta).2 versions - Latest release: 1 day ago - 0 downloads last month - 0 stars on GitHub - 1 maintainer
pytaser 23.6.3
TAS prediction tool14 versions - Latest release: over 3 years ago - 1 dependent repositories - 73 downloads last month - 30 stars on GitHub - 3 maintainers
mat_discover 2.2.9
Data-driven materials discovery based on composition or structure.33 versions - Latest release: over 3 years ago - 178 downloads last month - 47 stars on GitHub - 1 maintainer
mcseeker 0.1.2
从 Materials Project 检索晶体结构并导出可上传服务器的结构文件包3 versions - Latest release: 3 days ago - 0 downloads last month - 0 stars on GitHub - 1 maintainer
matgraph-cli 2.15.0
Complete computational materials science toolkit: ML predictions, DFT bridge, stability, band str...34 versions - Latest release: 3 months ago - 370 downloads last month - 0 stars on GitHub - 1 maintainer
nku-vasp-cli 0.4.1
Agent-first materials CLI. Build, edit and inspect 2D materials and catalytic interfaces with 1-4...4 versions - Latest release: 5 months ago - 331 downloads last month - 1 maintainer
matrouter 0.3.5
Local-first Python package for task-relative materials evidence routing with MCP integration.8 versions - Latest release: 3 months ago - 673 downloads last month - 2 maintainers
mp-search 0.1.3
Terminal UI tool for searching materials from the Materials Project database4 versions - Latest release: 8 months ago - 16 downloads last month - 4 stars on GitHub - 1 maintainer
materials-viewer-mp 1.0.0
Materials Project 材料查询工具 - 支持化学式查询、带隙筛选、3D可视化1 version - Latest release: 8 months ago - 44 downloads last month - 1 maintainer
ceraviz 0.1.1
Crystal structure visualization and Materials Project search tool2 versions - Latest release: 9 months ago - 36 downloads last month - 1 maintainer
mcp-materials-project 0.3.3
MCP Server for Materials Project database - query material properties, crystal structures, and ph...6 versions - Latest release: 10 months ago - 372 downloads last month - 1 maintainer
labmate-mcp 7.3.1
Your AI lab companion — 78 MCP tools from literature search to benchwork to publication4 versions - Latest release: 9 months ago - 441 downloads last month - 3 stars on GitHub - 1 maintainer
mp-time-split 0.2.0
Use Materials Project time-splits for generative modeling benchmarking.6 versions - Latest release: over 4 years ago - 1 dependent repositories - 22 downloads last month - 13 stars on GitHub - 1 maintainer
Related Keywords
materials-science
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pymatgen
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dft
4
mcp
3
materials-informatics
3
computational-chemistry
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crystal-structure
3
claude
2
chemistry
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pytorch
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cli
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materials-discovery
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machine-learning
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vasp
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agent
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peptide
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scientific-research
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organic-chemistry
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llm-tools
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molecular-formula
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iupac-nomenclature
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supporting-information
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peptide-design
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isoelectric-point
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experimental-templates
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thesis-writing
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journal-guides
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spps
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named-reactions
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citation-formatting
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periodic-table
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nmr-solvents
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protecting-groups
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amino-acids
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buffer-recipes
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molarity
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unit-conversion
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cas-validation
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isotope-pattern
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workup
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bench-chemistry
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dilution
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chromatography
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tlc
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SQS
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Phonon
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plot
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band
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DOS
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VASP
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DFT
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textual
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tui
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xrd
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python-sdk
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graph-neural-network
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gnome
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cgcnn
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thermoelectrics
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photovoltaics
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omat24
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megnet
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m3gnet
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graphql
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deep-learning
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chgnet
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catalysis
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agent-tool
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crystallography
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spectroscopy
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metal-oxides
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semiconductor-physics
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tas
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rowan
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pyvista
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visualization
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materials
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crystal
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physics
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wasserstein-metric
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wasserstein-distance
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wasserstein
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python
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predict-materials-properties
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numba
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materials-screening
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materials-discoveries
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matdiscover
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earth-movers-distance
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crabnet
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bayesian-optimization
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heterostructure
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