AB vasp-input-generator
Generate VASP DFT calculation input files (INCAR, KPOINTS, POSCAR, POTCAR). Use when Codex needs to create, modify, or validate VASP input files for: (1) Structural optimization, (2) Electronic structure calculations, (3) MD simulations, (4) Band structure calculations, (5) DOS calculations, or any other VASP-related tasks.
As a process B 67/100 · Nearly there — weak spots: when it triggers, failures and branches, running it twice
How to improve
- Your own cases (evals/evals.json, 4–6 real requests with expected answers): the full check would then run those instead of a model-drafted suite.
- A spec.yaml with trigger phrases and assertions — a behaviour contract for CI; `skilltest init` writes a template.
Guard findings · 0
✓ No critical or high findings
Files scanned: 4. Evidence is masked. Grey chips explain why severity was lowered.
Against the Agent Skills spec
- warning
frontmatter-yamlSKILL.md: the frontmatter is not valid YAML (YAML parse error: Nested mappings are not allowed in compact mappings at line 2, column 14: description: Generate VASP DFT calculation input files (INCAR, KPOINTS, POSCAR,… ^ ); fields were read line by line. The usual cause is a colon inside an unquoted value
Process rating: all ten parameters 67/100
- 0Failures and branches. Linear process with no failure handling
- 0Progress reporting. Says nothing while it works
- 20When it triggers. No condition that starts the skill
- 30Running it twice. 1 mutating operations with no state check
- 60Result and completion. Output format stated, no completion criterion
- 70Inputs and preconditions. Inputs and preconditions are listed
- 100Tools and files. No external tools needed
- 100Steps. 13 steps
- 100Consistency. Name and required fields are in place
- 100Execution cost. Instruction body is 373 tokens
Everything here is measured from the skill text rather than judged by a model, so the numbers are checkable. A parameter weighs more when it is a more common reason for the process to stall.
Quality signals
- +5Description has no quoted example phrases that should trigger the skill
- +4Description does not say when NOT to use the skill (false activations)
- +1No license
- +2Single-language instructions
- +3Description length 325: enough signal without eating the budget
- +4Structure: 7 headings
- +3Step-by-step instructions: 13 items
- +3Output format is stated explicitly
- +4Has examples (1 code blocks)
- +4Reference files are cited in the instructions (1 of 1)
- +3All 1 scripts are documented
Quality base 70; lint remarks subtract, signals add up to 100. Result: 84.