diff --git a/ironflow/model/node.py b/ironflow/model/node.py index 8023b353..b7993e73 100644 --- a/ironflow/model/node.py +++ b/ironflow/model/node.py @@ -524,7 +524,7 @@ class attribute. valid_job_classes = None init_inputs = [ NodeInputBP(type_="exec", label="run"), - NodeInputBP(type_="exec", label="remove"), + NodeInputBP(type_="exec", label="reset"), NodeInputBP(dtype=dtypes.String(default="calc"), label="name"), ] init_outputs = [ diff --git a/ironflow/nodes/pyiron/atomistics_nodes.py b/ironflow/nodes/pyiron/atomistics_nodes.py index 935aad02..f5c716da 100644 --- a/ironflow/nodes/pyiron/atomistics_nodes.py +++ b/ironflow/nodes/pyiron/atomistics_nodes.py @@ -107,6 +107,11 @@ class Project_Node(DataNode): title = "Project" init_inputs = [ NodeInputBP(dtype=dtypes.String(default="."), label="name"), + NodeInputBP(label="remove", type_="exec"), + NodeInputBP(label="enable_remove", dtype=dtypes.Boolean(default=False)), + NodeInputBP(label="remove_name", dtype=dtypes.String()), + NodeInputBP(label="remove_all", dtype=dtypes.Boolean(default=False)), + NodeInputBP(label="recursive", dtype=dtypes.Boolean(default=True)), ] init_outputs = [ NodeOutputBP( @@ -117,6 +122,23 @@ class Project_Node(DataNode): ] color = "#aabb44" + def update_event(self, inp=-1): + if inp == 1: + if self.inputs.values.enable_remove: + if self.inputs.values.remove_all: + self.outputs.values.project.remove_jobs( + recursive=self.inputs.values.recursive, silently=True + ) + else: + self.outputs.values.project.remove_job( + self.inputs.values.remove_name + ) + else: + InfoMsgs.write( + "`enable_remove` must be set to `True` before removing jobs." + ) + super().update_event(inp=inp) + def node_function(self, name, **kwargs) -> dict: return {"project": Project(name)} diff --git a/notebooks/bulk_modulus.ipynb b/notebooks/bulk_modulus.ipynb index effa52d8..4eaacae7 100644 --- a/notebooks/bulk_modulus.ipynb +++ b/notebooks/bulk_modulus.ipynb @@ -46,7 +46,6 @@ " - Observe: Without knowing a-priori which nodes we need to use, we simply follow recommendations to populate our graph\n", " - Observe: When `Lammps.outputs.engine` is connected to `CalcMurnaghan.inputs.engine`, the only recommendation for `Lammps.inputs.structure` is `BulkStructure` -- but when we disconnect these, Lammps sees both `BulkStructure` _and_ `SlabStructure`! This is because the requirements of the Murnaghan job to be calculated on a bulk structure get propogated upstream by the graph and processed by the ontology reasoner. \n", "11. Run the `CalcMurnaghan` job\n", - " - Observe: If you use `SHOW` to investigate the `CalcMurnaghan` and `MaterialProperty` node outputs, you'll see that the bulk modulus gets converted from the Murnaghan units of GPa to the ontology's units of MPa.\n", "12. Select `MaterialProperty` again, and choose `B_prime` from the `property` dropdown.\n", " - Observe: The `eq_bulk_modulus` output of `CalcMurnaghan` still has a green (valid) output port, but the `source` input port of `MaterialProperty` is now red (invalid) -- this is because the provided ontological type no longer matches the requested property.\n", "13. Click on the `source` input port again; disconnect it from `eq_bulk_modulus` and reconnect it to the recommended port." diff --git a/notebooks/example.json b/notebooks/example.json index cae18a8b..aca700ae 100644 --- a/notebooks/example.json +++ b/notebooks/example.json @@ -6,36 +6,6 @@ "flow": { "algorithm mode": "data", "nodes": [ - { - "identifier": "Project_Node", - "version": null, - "state data": "gAR9lC4=", - "additional data": {}, - "inputs": [ - { - "type": "data", - "label": "name", - "GID": 9, - "val": "gASVCwAAAAAAAACMB2V4YW1wbGWULg==", - "dtype": "DType.String", - "dtype state": "gASVigAAAAAAAAB9lCiMB2RlZmF1bHSUjAEulIwDdmFslGgCjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwDc3RylJOUjAVudW1weZSMBHN0cl+Uk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UdS4=" - } - ], - "outputs": [ - { - "type": "data", - "label": "project", - "GID": 10, - "dtype": "DType.Data", - "dtype state": "gASViQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjBlweWlyb25fYXRvbWlzdGljcy5wcm9qZWN0lIwHUHJvamVjdJSTlGGMCmFsbG93X25vbmWUiYwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==", - "otype_namespace": "atomistics", - "otype_name": "project_output_atomistics_project" - } - ], - "GID": 8, - "pos x": 86.42384105960265, - "pos y": 59.701492537313435 - }, { "identifier": "BulkStructure_Node", "version": null, @@ -207,164 +177,6 @@ "pos x": 595.4282440561444, "pos y": 248.4835164835165 }, - { - "identifier": "CalcMD_Node", - "version": null, - "state data": "gAR9lC4=", - "additional data": {}, - "inputs": [ - { - "type": "exec", - "label": "run", - "GID": 31, - "val": "gAROLg==", - "dtype": "DType.Untyped", - "dtype state": "gASVVQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiXUu" - }, - { - "type": "exec", - "label": "remove", - "GID": 32, - "val": "gAROLg==", - "dtype": "DType.Untyped", - "dtype state": "gASVVQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiXUu" - }, - { - "type": "data", - "label": "name", - "GID": 33, - "val": "gASVCwAAAAAAAACMB2NhbGNfbWSULg==", - "dtype": "DType.String", - "dtype state": "gASVjQAAAAAAAAB9lCiMB2RlZmF1bHSUjARjYWxjlIwDdmFslGgCjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwDc3RylJOUjAVudW1weZSMBHN0cl+Uk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UdS4=" - }, - { - "type": "data", - "label": "job", - "GID": 34, - "dtype": "DType.Data", - "dtype state": "gASVjgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjB9weWlyb25fYXRvbWlzdGljcy5sYW1tcHMubGFtbXBzlIwGTGFtbXBzlJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu", - "otype_namespace": "atomistics", - "otype_name": "atomistic_taker_job" - }, - { - "type": "data", - "label": "temperature", - "GID": 35, - "val": "gASVCgAAAAAAAABHQHQwAAAAAAAu", - "dtype": "DType.Float", - "dtype state": "gASVmQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjAVmbG9hdJSTlIwFbnVtcHmUjAhmbG9hdGluZ5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZSMCGRlY2ltYWxzlEsKdS4=" - }, - { - "type": "data", - "label": "pressure", - "GID": 36, - "val": "gAROLg==", - "dtype": "DType.Data", - "dtype state": "gASVlgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjAVmbG9hdJSTlGgIjARsaXN0lJOUjAVudW1weZSMB25kYXJyYXmUk5RljAphbGxvd19ub25llIiMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UdS4=" - }, - { - "type": "data", - "label": "n_ionic_steps", - "GID": 37, - "val": "gASVBAAAAAAAAABN6AMu", - "dtype": "DType.Integer", - "dtype state": "gASVjQAAAAAAAAB9lCiMB2RlZmF1bHSUTegDjAN2YWyUTegDjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwDaW50lJOUjAVudW1weZSMB2ludGVnZXKUk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UdS4=" - }, - { - "type": "data", - "label": "time_step", - "GID": 38, - "val": "gASVCgAAAAAAAABHP/AAAAAAAAAu", - "dtype": "DType.Float", - "dtype state": "gASVqQAAAAAAAAB9lCiMB2RlZmF1bHSURz/wAAAAAAAAjAN2YWyURz/wAAAAAAAAjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwFZmxvYXSUk5SMBW51bXB5lIwIZmxvYXRpbmeUk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UjAhkZWNpbWFsc5RLCnUu" - }, - { - "type": "data", - "label": "n_print", - "GID": 39, - "val": "gARLCi4=", - "dtype": "DType.Integer", - "dtype state": "gASViwAAAAAAAAB9lCiMB2RlZmF1bHSUS2SMA3ZhbJRLZIwDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZQojAhidWlsdGluc5SMA2ludJSTlIwFbnVtcHmUjAdpbnRlZ2VylJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" - }, - { - "type": "data", - "label": "temperature_damping_timescale", - "GID": 40, - "val": "gASVCgAAAAAAAABHQFkAAAAAAAAu", - "dtype": "DType.Float", - "dtype state": "gASVqQAAAAAAAAB9lCiMB2RlZmF1bHSUR0BZAAAAAAAAjAN2YWyUR0BZAAAAAAAAjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwFZmxvYXSUk5SMBW51bXB5lIwIZmxvYXRpbmeUk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UjAhkZWNpbWFsc5RLCnUu" - }, - { - "type": "data", - "label": "pressure_damping_timescale", - "GID": 41, - "val": "gASVCgAAAAAAAABHQI9AAAAAAAAu", - "dtype": "DType.Float", - "dtype state": "gASVqQAAAAAAAAB9lCiMB2RlZmF1bHSUR0CPQAAAAAAAjAN2YWyUR0CPQAAAAAAAjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwFZmxvYXSUk5SMBW51bXB5lIwIZmxvYXRpbmeUk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UjAhkZWNpbWFsc5RLCnUu" - }, - { - "type": "data", - "label": "seed", - "GID": 42, - "val": "gAROLg==", - "dtype": "DType.Integer", - "dtype state": "gASViQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANpbnSUk5SMBW51bXB5lIwHaW50ZWdlcpSTlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" - }, - { - "type": "data", - "label": "initial_temperature", - "GID": 43, - "val": "gAROLg==", - "dtype": "DType.Float", - "dtype state": "gASVmQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjAVmbG9hdJSTlIwFbnVtcHmUjAhmbG9hdGluZ5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZSMCGRlY2ltYWxzlEsKdS4=" - }, - { - "type": "data", - "label": "dynamics", - "GID": 44, - "val": "gASVDAAAAAAAAACMCGxhbmdldmlulC4=", - "dtype": "DType.Choice", - "dtype state": "gASVfAAAAAAAAAB9lCiMB2RlZmF1bHSUjAhsYW5nZXZpbpSMA3ZhbJRoAowDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZSMCmFsbG93X25vbmWUiYwHYmF0Y2hlZJSJjAVpdGVtc5RdlChoAowLbm9zZS1ob292ZXKUZXUu" - } - ], - "outputs": [ - { - "type": "exec", - "label": "ran", - "GID": 45, - "dtype": "DType.Untyped", - "dtype state": "gASVVQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiXUu" - }, - { - "type": "data", - "label": "job", - "GID": 46, - "dtype": "DType.Data", - "dtype state": "gASVjgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjB9weWlyb25fYXRvbWlzdGljcy5sYW1tcHMubGFtbXBzlIwGTGFtbXBzlJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" - }, - { - "type": "data", - "label": "energy_pot", - "GID": 47, - "dtype": "DType.Float", - "dtype state": "gASVqQAAAAAAAAB9lCiMB2RlZmF1bHSURwAAAAAAAAAAjAN2YWyURwAAAAAAAAAAjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwFZmxvYXSUk5SMBW51bXB5lIwIZmxvYXRpbmeUk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UjAhkZWNpbWFsc5RLCnUu", - "otype_namespace": "atomistics", - "otype_name": "atomistic_taker_output_energy_pot" - }, - { - "type": "data", - "label": "forces", - "GID": 48, - "dtype": "DType.List", - "dtype state": "gASVgQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjAVmbG9hdJSTlIwFbnVtcHmUjAhmbG9hdGluZ5STlGWMCmFsbG93X25vbmWUiYwHYmF0Y2hlZJSJdS4=", - "otype_namespace": "atomistics", - "otype_name": "atomistic_taker_output_forces" - } - ], - "GID": 30, - "pos x": 879.2208536236036, - "pos y": 102.4835164835165 - }, { "identifier": "Matplot_Node", "version": "v0.1", @@ -374,21 +186,21 @@ { "type": "data", "label": "x", - "GID": 58, + "GID": 50, "dtype": "DType.Untyped", "dtype state": "gASVVQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiXUu" }, { "type": "data", "label": "y", - "GID": 59, + "GID": 51, "dtype": "DType.Untyped", "dtype state": "gASVVQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiXUu" }, { "type": "data", "label": "fig", - "GID": 60, + "GID": 52, "val": "gAROLg==", "dtype": "DType.Data", "dtype state": "gASVgAAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjBFtYXRwbG90bGliLmZpZ3VyZZSMBkZpZ3VyZZSTlGGMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" @@ -396,7 +208,7 @@ { "type": "data", "label": "marker", - "GID": 61, + "GID": 53, "val": "gASVBQAAAAAAAACMAW+ULg==", "dtype": "DType.Choice", "dtype state": "gASVzgAAAAAAAAB9lCiMB2RlZmF1bHSUjAFvlIwDdmFslGgCjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlIwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBWl0ZW1zlF2UKIwEbm9uZZSMAS6UjAEslGgCjAF2lIwBXpSMATyUjAE+lIwBMZSMATKUjAEzlIwBNJSMATiUjAFzlIwBcJSMAVCUjAEqlIwBaJSMAUiUjAErlIwBeJSMAViUjAFklIwBRJSMAXyUjAFflGV1Lg==" @@ -404,7 +216,7 @@ { "type": "data", "label": "linestyle", - "GID": 62, + "GID": 54, "val": "gASVCAAAAAAAAACMBG5vbmWULg==", "dtype": "DType.Choice", "dtype state": "gASVjgAAAAAAAAB9lCiMB2RlZmF1bHSUjARub25llIwDdmFslGgCjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlIwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBWl0ZW1zlF2UKGgCjAVzb2xpZJSMBmRvdHRlZJSMBmRhc2hlZJSMB2Rhc2hkb3SUZXUu" @@ -412,7 +224,7 @@ { "type": "data", "label": "color", - "GID": 63, + "GID": 55, "val": "gAROLg==", "dtype": "DType.String", "dtype state": "gASVhgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANzdHKUk5SMBW51bXB5lIwEc3RyX5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" @@ -420,7 +232,7 @@ { "type": "data", "label": "alpha", - "GID": 64, + "GID": 56, "val": "gASVCgAAAAAAAABHP/AAAAAAAAAu", "dtype": "DType.Float", "dtype state": "gASVqQAAAAAAAAB9lCiMB2RlZmF1bHSURz/wAAAAAAAAjAN2YWyURz/wAAAAAAAAjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwFZmxvYXSUk5SMBW51bXB5lIwIZmxvYXRpbmeUk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UjAhkZWNpbWFsc5RLCnUu" @@ -428,7 +240,7 @@ { "type": "data", "label": "label", - "GID": 65, + "GID": 57, "val": "gAROLg==", "dtype": "DType.String", "dtype state": "gASVhgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANzdHKUk5SMBW51bXB5lIwEc3RyX5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" @@ -436,7 +248,7 @@ { "type": "data", "label": "xlabel", - "GID": 66, + "GID": 58, "val": "gAROLg==", "dtype": "DType.String", "dtype state": "gASVhgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANzdHKUk5SMBW51bXB5lIwEc3RyX5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" @@ -444,7 +256,7 @@ { "type": "data", "label": "ylabel", - "GID": 67, + "GID": 59, "val": "gAROLg==", "dtype": "DType.String", "dtype state": "gASVhgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANzdHKUk5SMBW51bXB5lIwEc3RyX5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" @@ -452,7 +264,7 @@ { "type": "data", "label": "title", - "GID": 68, + "GID": 60, "val": "gAROLg==", "dtype": "DType.String", "dtype state": "gASVhgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANzdHKUk5SMBW51bXB5lIwEc3RyX5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" @@ -460,7 +272,7 @@ { "type": "data", "label": "legend", - "GID": 69, + "GID": 61, "val": "gASJLg==", "dtype": "DType.Boolean", "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -468,7 +280,7 @@ { "type": "data", "label": "tight_layout", - "GID": 70, + "GID": 62, "val": "gASILg==", "dtype": "DType.Boolean", "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiIwDdmFslIiMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -478,12 +290,12 @@ { "type": "data", "label": "fig", - "GID": 71, + "GID": 63, "dtype": "DType.Data", "dtype state": "gASVgAAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjBFtYXRwbG90bGliLmZpZ3VyZZSMBkZpZ3VyZZSTlGGMCmFsbG93X25vbmWUiYwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" } ], - "GID": 57, + "GID": 49, "pos x": 1527.2071039816672, "pos y": 158.24175824175825 }, @@ -496,22 +308,22 @@ { "type": "data", "label": "job", - "GID": 248, + "GID": 65, "dtype": "DType.Data", "dtype state": "gASVpgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjCpweWlyb25fYXRvbWlzdGljcy5hdG9taXN0aWNzLmpvYi5hdG9taXN0aWOUjBNBdG9taXN0aWNHZW5lcmljSm9ilJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" }, { "type": "data", "label": "field", - "GID": 249, + "GID": 66, "val": "gASVCQAAAAAAAACMBXN0ZXBzlC4=", "dtype": "DType.Choice", - "dtype state": "gASVUgEAAAAAAAB9lCiMB2RlZmF1bHSUjAVzdGVwc5SMA3ZhbJRoAowDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZSMCGJ1aWx0aW5zlIwDc3RylJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBWl0ZW1zlI+UKIwGZm9yY2VzlIwHaW5kaWNlc5SMEGNvbXB1dGF0aW9uX3RpbWWUjAlmb3JjZV9tYXiUjAplbmVyZ3lfcG90lIwTdG90YWxfZGlzcGxhY2VtZW50c5RoAowJcHJlc3N1cmVzlIwTdW53cmFwcGVkX3Bvc2l0aW9uc5SMDWRpc3BsYWNlbWVudHOUjAt0ZW1wZXJhdHVyZZSMCXBvc2l0aW9uc5SMEWdldF9kaXNwbGFjZW1lbnRzlIwKZW5lcmd5X3RvdJSMBnZvbHVtZZSMBWNlbGxzlJB1Lg==" + "dtype state": "gASVUgEAAAAAAAB9lCiMB2RlZmF1bHSUjAVzdGVwc5SMA3ZhbJRoAowDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZSMCGJ1aWx0aW5zlIwDc3RylJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBWl0ZW1zlI+UKIwKZW5lcmd5X3BvdJSMC3RlbXBlcmF0dXJllIwKZW5lcmd5X3RvdJRoAowQY29tcHV0YXRpb25fdGltZZSME3RvdGFsX2Rpc3BsYWNlbWVudHOUjAlwb3NpdGlvbnOUjAdpbmRpY2VzlIwFY2VsbHOUjA1kaXNwbGFjZW1lbnRzlIwGZm9yY2VzlIwJcHJlc3N1cmVzlIwGdm9sdW1llIwTdW53cmFwcGVkX3Bvc2l0aW9uc5SMCWZvcmNlX21heJSMEWdldF9kaXNwbGFjZW1lbnRzlJB1Lg==" }, { "type": "data", "label": "transpose", - "GID": 250, + "GID": 67, "val": "gASJLg==", "dtype": "DType.Boolean", "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -519,7 +331,7 @@ { "type": "data", "label": "index", - "GID": 251, + "GID": 68, "val": "gAROLg==", "dtype": "DType.Integer", "dtype state": "gASViQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANpbnSUk5SMBW51bXB5lIwHaW50ZWdlcpSTlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" @@ -529,12 +341,12 @@ { "type": "data", "label": "output", - "GID": 252, + "GID": 69, "dtype": "DType.List", "dtype state": "gASViQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANpbnSUk5RoCIwFZmxvYXSUk5SMBW51bXB5lIwGbnVtYmVylJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklIl1Lg==" } ], - "GID": 247, + "GID": 64, "pos x": 1212.6152964766543, "pos y": 98.9010989010989 }, @@ -547,22 +359,22 @@ { "type": "data", "label": "job", - "GID": 254, + "GID": 71, "dtype": "DType.Data", "dtype state": "gASVpgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjCpweWlyb25fYXRvbWlzdGljcy5hdG9taXN0aWNzLmpvYi5hdG9taXN0aWOUjBNBdG9taXN0aWNHZW5lcmljSm9ilJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" }, { "type": "data", "label": "field", - "GID": 255, + "GID": 72, "val": "gASVDwAAAAAAAACMC3RlbXBlcmF0dXJllC4=", "dtype": "DType.Choice", - "dtype state": "gASVUgEAAAAAAAB9lCiMB2RlZmF1bHSUjAVzdGVwc5SMA3ZhbJRoAowDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZSMCGJ1aWx0aW5zlIwDc3RylJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBWl0ZW1zlI+UKIwGZm9yY2VzlIwHaW5kaWNlc5SMEGNvbXB1dGF0aW9uX3RpbWWUjAlmb3JjZV9tYXiUjAplbmVyZ3lfcG90lIwTdG90YWxfZGlzcGxhY2VtZW50c5RoAowJcHJlc3N1cmVzlIwTdW53cmFwcGVkX3Bvc2l0aW9uc5SMDWRpc3BsYWNlbWVudHOUjAt0ZW1wZXJhdHVyZZSMCXBvc2l0aW9uc5SMEWdldF9kaXNwbGFjZW1lbnRzlIwKZW5lcmd5X3RvdJSMBnZvbHVtZZSMBWNlbGxzlJB1Lg==" + "dtype state": "gASVUgEAAAAAAAB9lCiMB2RlZmF1bHSUjAVzdGVwc5SMA3ZhbJRoAowDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZSMCGJ1aWx0aW5zlIwDc3RylJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBWl0ZW1zlI+UKIwKZW5lcmd5X3BvdJSMC3RlbXBlcmF0dXJllIwKZW5lcmd5X3RvdJRoAowQY29tcHV0YXRpb25fdGltZZSME3RvdGFsX2Rpc3BsYWNlbWVudHOUjAlwb3NpdGlvbnOUjAdpbmRpY2VzlIwFY2VsbHOUjA1kaXNwbGFjZW1lbnRzlIwGZm9yY2VzlIwJcHJlc3N1cmVzlIwGdm9sdW1llIwTdW53cmFwcGVkX3Bvc2l0aW9uc5SMCWZvcmNlX21heJSMEWdldF9kaXNwbGFjZW1lbnRzlJB1Lg==" }, { "type": "data", "label": "transpose", - "GID": 256, + "GID": 73, "val": "gASJLg==", "dtype": "DType.Boolean", "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -570,7 +382,7 @@ { "type": "data", "label": "index", - "GID": 257, + "GID": 74, "val": "gAROLg==", "dtype": "DType.Integer", "dtype state": "gASViQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANpbnSUk5SMBW51bXB5lIwHaW50ZWdlcpSTlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" @@ -580,84 +392,15 @@ { "type": "data", "label": "output", - "GID": 258, + "GID": 75, "dtype": "DType.List", "dtype state": "gASViQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANpbnSUk5RoCIwFZmxvYXSUk5SMBW51bXB5lIwGbnVtYmVylJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklIl1Lg==" } ], - "GID": 253, + "GID": 70, "pos x": 1225.8149527356059, "pos y": 358.24175824175825 - } - ], - "connections": [ - { - "GID": 72, - "parent node index": 0, - "output port index": 0, - "connected node": 3, - "connected input port index": 0 - }, - { - "GID": 73, - "parent node index": 1, - "output port index": 0, - "connected node": 2, - "connected input port index": 0 - }, - { - "GID": 74, - "parent node index": 2, - "output port index": 0, - "connected node": 3, - "connected input port index": 1 - }, - { - "GID": 75, - "parent node index": 3, - "output port index": 0, - "connected node": 4, - "connected input port index": 3 - }, - { - "GID": 259, - "parent node index": 4, - "output port index": 1, - "connected node": 6, - "connected input port index": 0 - }, - { - "GID": 260, - "parent node index": 4, - "output port index": 1, - "connected node": 7, - "connected input port index": 0 - }, - { - "GID": 261, - "parent node index": 6, - "output port index": 0, - "connected node": 5, - "connected input port index": 0 }, - { - "GID": 262, - "parent node index": 7, - "output port index": 0, - "connected node": 5, - "connected input port index": 1 - } - ], - "GID": 7 - }, - "GID": 1 - }, - { - "title": "EV-curve", - "variables": {}, - "flow": { - "algorithm mode": "data", - "nodes": [ { "identifier": "Project_Node", "version": null, @@ -667,27 +410,294 @@ { "type": "data", "label": "name", - "GID": 88, - "val": "gASVBQAAAAAAAACMAS6ULg==", + "GID": 231, + "val": "gASVCwAAAAAAAACMB2V4YW1wbGWULg==", "dtype": "DType.String", "dtype state": "gASVigAAAAAAAAB9lCiMB2RlZmF1bHSUjAEulIwDdmFslGgCjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwDc3RylJOUjAVudW1weZSMBHN0cl+Uk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UdS4=" + }, + { + "type": "exec", + "label": "remove", + "GID": 232, + "val": "gAROLg==", + "dtype": "DType.Untyped", + "dtype state": "gASVVQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiXUu" + }, + { + "type": "data", + "label": "enable_remove", + "GID": 233, + "val": "gASJLg==", + "dtype": "DType.Boolean", + "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" + }, + { + "type": "data", + "label": "remove_name", + "GID": 234, + "val": "gASVBAAAAAAAAACMAJQu", + "dtype": "DType.String", + "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUjACUjAN2YWyUaAKMA2RvY5RoAowGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZQojAhidWlsdGluc5SMA3N0cpSTlIwFbnVtcHmUjARzdHJflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" + }, + { + "type": "data", + "label": "remove_all", + "GID": 235, + "val": "gASJLg==", + "dtype": "DType.Boolean", + "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" + }, + { + "type": "data", + "label": "recursive", + "GID": 236, + "val": "gASILg==", + "dtype": "DType.Boolean", + "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiIwDdmFslIiMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" } ], "outputs": [ { "type": "data", "label": "project", - "GID": 89, + "GID": 237, "dtype": "DType.Data", "dtype state": "gASViQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjBlweWlyb25fYXRvbWlzdGljcy5wcm9qZWN0lIwHUHJvamVjdJSTlGGMCmFsbG93X25vbmWUiYwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==", "otype_namespace": "atomistics", "otype_name": "project_output_atomistics_project" } ], - "GID": 87, - "pos x": 19.043254081924943, - "pos y": 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+ "connected node": 4, + "connected input port index": 0 + }, + { + "GID": 259, + "parent node index": 7, + "output port index": 1, + "connected node": 5, + "connected input port index": 0 + } + ], + "GID": 7 + }, + "GID": 1 + }, + { + "title": "EV-curve", + "variables": {}, + "flow": { + "algorithm mode": "data", + "nodes": [ { "identifier": "Linspace_Node", "version": null, @@ -697,7 +707,7 @@ { "type": "data", "label": "min", - "GID": 91, + "GID": 95, "val": "gASVCgAAAAAAAABHQA5mZmZmZmYu", "dtype": "DType.Float", "dtype state": "gASVqQAAAAAAAAB9lCiMB2RlZmF1bHSURz/wAAAAAAAAjAN2YWyURz/wAAAAAAAAjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwFZmxvYXSUk5SMBW51bXB5lIwIZmxvYXRpbmeUk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UjAhkZWNpbWFsc5RLCnUu" @@ -705,7 +715,7 @@ { "type": "data", "label": "max", - "GID": 92, + "GID": 96, "val": "gASVCgAAAAAAAABHQBDMzMzMzM0u", "dtype": "DType.Float", "dtype state": 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"data", "label": "element", - "GID": 96, + "GID": 100, "val": "gASVBgAAAAAAAACMAkFslC4=", "dtype": "DType.String", "dtype state": "gASViwAAAAAAAAB9lCiMB2RlZmF1bHSUjAJGZZSMA3ZhbJRoAowDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZQojAhidWlsdGluc5SMA3N0cpSTlIwFbnVtcHmUjARzdHJflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu", @@ -751,7 +761,7 @@ { "type": "data", "label": "crystal_structure", - "GID": 97, + "GID": 101, "val": "gAROLg==", "dtype": "DType.Choice", "dtype state": "gASVwgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiYwFaXRlbXOUXZQoTowCc2OUjANmY2OUjANiY2OUjANoY3CUjAdkaWFtb25klIwKemluY2JsZW5kZZSMCHJvY2tzYWx0lIwOY2VzaXVtY2hsb3JpZGWUjAhmbHVvcml0ZZSMCHd1cnR6aXRllGV1Lg==" @@ -759,14 +769,14 @@ { "type": "data", "label": "a", - "GID": 98, + "GID": 102, "dtype": "DType.Float", "dtype state": 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+ "GID": 105, "val": "gAROLg==", "dtype": "DType.Float", "dtype state": "gASVmQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjAVmbG9hdJSTlIwFbnVtcHmUjAhmbG9hdGluZ5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZSMCGRlY2ltYWxzlEsKdS4=" @@ -790,7 +800,7 @@ { "type": "data", "label": "orthorhombic", - "GID": 102, + "GID": 106, "val": "gASJLg==", "dtype": "DType.Boolean", "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -798,7 +808,7 @@ { "type": "data", "label": "cubic", - "GID": 103, + "GID": 107, "val": "gASJLg==", "dtype": "DType.Boolean", "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -808,14 +818,14 @@ { "type": "data", "label": "structure", - "GID": 104, + "GID": 108, "dtype": "DType.Data", "dtype state": "gASVmgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjCxweWlyb25fYXRvbWlzdGljcy5hdG9taXN0aWNzLnN0cnVjdHVyZS5hdG9tc5SMBUF0b21zlJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklIiMBHNpemWUjAFtlHUu", "otype_namespace": "atomistics", "otype_name": "bulk_structure_output_structure" } ], - "GID": 95, + "GID": 99, "pos x": 294.03609281008306, "pos y": 178.08791208791212 }, @@ -828,7 +838,7 @@ { "type": "data", "label": "project", - "GID": 106, + "GID": 110, "dtype": "DType.Data", "dtype state": "gASViQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjBlweWlyb25fYXRvbWlzdGljcy5wcm9qZWN0lIwHUHJvamVjdJSTlGGMCmFsbG93X25vbmWUiYwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==", "otype_namespace": "atomistics", @@ -837,7 +847,7 @@ { "type": "data", "label": "structure", - "GID": 107, + "GID": 111, "dtype": "DType.Data", "dtype state": 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"gASVVQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiXUu" - }, - { - "type": "data", - "label": "job", - "GID": 116, - "dtype": "DType.Data", - "dtype state": "gASVjgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjB9weWlyb25fYXRvbWlzdGljcy5sYW1tcHMubGFtbXBzlIwGTGFtbXBzlJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklIiMBHNpemWUjAFtlHUu" - }, - { - "type": "data", - "label": "energy_pot", - "GID": 117, - "dtype": "DType.Float", - "dtype state": "gASVqQAAAAAAAAB9lCiMB2RlZmF1bHSURwAAAAAAAAAAjAN2YWyURwAAAAAAAAAAjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwFZmxvYXSUk5SMBW51bXB5lIwIZmxvYXRpbmeUk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiIwEc2l6ZZSMAW2UjAhkZWNpbWFsc5RLCnUu", - "otype_namespace": "atomistics", - "otype_name": "atomistic_taker_output_energy_pot" - }, - { - "type": "data", - "label": "forces", - "GID": 118, - "dtype": "DType.List", - "dtype state": "gASVgQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjAVmbG9hdJSTlIwFbnVtcHmUjAhmbG9hdGluZ5STlGWMCmFsbG93X25vbmWUiYwHYmF0Y2hlZJSIdS4=", - "otype_namespace": "atomistics", - "otype_name": "atomistic_taker_output_forces" - } - ], - "GID": 110, - "pos x": 830.8221140074477, - "pos y": 31.087912087912088 - }, { "identifier": "Matplot_Node", "version": "v0.1", @@ -954,21 +886,21 @@ { "type": "data", "label": "x", - "GID": 134, + "GID": 124, "dtype": "DType.Untyped", "dtype state": "gASVVQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiXUu" }, { "type": "data", "label": "y", - "GID": 135, + "GID": 125, "dtype": "DType.Untyped", "dtype state": "gASVVQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiXUu" }, { "type": "data", "label": "fig", - "GID": 136, + "GID": 126, "val": "gAROLg==", "dtype": "DType.Data", "dtype state": "gASVgAAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjBFtYXRwbG90bGliLmZpZ3VyZZSMBkZpZ3VyZZSTlGGMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" @@ -976,7 +908,7 @@ { "type": "data", "label": "marker", - "GID": 137, + "GID": 127, "val": "gASVBQAAAAAAAACMAW+ULg==", "dtype": "DType.Choice", "dtype state": "gASVzgAAAAAAAAB9lCiMB2RlZmF1bHSUjAFvlIwDdmFslGgCjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlIwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBWl0ZW1zlF2UKIwEbm9uZZSMAS6UjAEslGgCjAF2lIwBXpSMATyUjAE+lIwBMZSMATKUjAEzlIwBNJSMATiUjAFzlIwBcJSMAVCUjAEqlIwBaJSMAUiUjAErlIwBeJSMAViUjAFklIwBRJSMAXyUjAFflGV1Lg==" @@ -984,7 +916,7 @@ { "type": "data", "label": "linestyle", - "GID": 138, + "GID": 128, "val": "gASVCAAAAAAAAACMBG5vbmWULg==", "dtype": "DType.Choice", "dtype state": "gASVjgAAAAAAAAB9lCiMB2RlZmF1bHSUjARub25llIwDdmFslGgCjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlIwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBWl0ZW1zlF2UKGgCjAVzb2xpZJSMBmRvdHRlZJSMBmRhc2hlZJSMB2Rhc2hkb3SUZXUu" @@ -992,7 +924,7 @@ { "type": "data", "label": "color", - "GID": 139, + "GID": 129, "val": "gAROLg==", "dtype": "DType.String", "dtype state": "gASVhgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANzdHKUk5SMBW51bXB5lIwEc3RyX5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" @@ -1000,7 +932,7 @@ { "type": "data", "label": "alpha", - "GID": 140, + "GID": 130, "val": "gASVCgAAAAAAAABHP/AAAAAAAAAu", "dtype": "DType.Float", "dtype state": "gASVqQAAAAAAAAB9lCiMB2RlZmF1bHSURz/wAAAAAAAAjAN2YWyURz/wAAAAAAAAjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwFZmxvYXSUk5SMBW51bXB5lIwIZmxvYXRpbmeUk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UjAhkZWNpbWFsc5RLCnUu" @@ -1008,7 +940,7 @@ { "type": "data", "label": "label", - "GID": 141, + "GID": 131, "val": "gAROLg==", "dtype": "DType.String", "dtype state": "gASVhgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANzdHKUk5SMBW51bXB5lIwEc3RyX5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" @@ -1016,7 +948,7 @@ { "type": "data", "label": "xlabel", - "GID": 142, + "GID": 132, "val": "gAROLg==", "dtype": "DType.String", "dtype state": "gASVhgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANzdHKUk5SMBW51bXB5lIwEc3RyX5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" @@ -1024,7 +956,7 @@ { "type": "data", "label": "ylabel", - "GID": 143, + "GID": 133, "val": "gAROLg==", "dtype": "DType.String", "dtype state": "gASVhgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANzdHKUk5SMBW51bXB5lIwEc3RyX5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" @@ -1032,7 +964,7 @@ { "type": "data", "label": "title", - "GID": 144, + "GID": 134, "val": "gAROLg==", "dtype": "DType.String", "dtype state": "gASVhgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANzdHKUk5SMBW51bXB5lIwEc3RyX5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" @@ -1040,7 +972,7 @@ { "type": "data", "label": "legend", - "GID": 145, + "GID": 135, "val": "gASJLg==", "dtype": "DType.Boolean", "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -1048,7 +980,7 @@ { "type": "data", "label": "tight_layout", - "GID": 146, + "GID": 136, "val": "gASILg==", "dtype": "DType.Boolean", "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiIwDdmFslIiMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -1058,12 +990,12 @@ { "type": "data", "label": "fig", - "GID": 147, + "GID": 137, "dtype": "DType.Data", "dtype state": "gASVgAAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjBFtYXRwbG90bGliLmZpZ3VyZZSMBkZpZ3VyZZSTlGGMCmFsbG93X25vbmWUiYwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" } ], - "GID": 133, + "GID": 123, "pos x": 1312.6095674591807, "pos y": 306.6923076923077 }, @@ -1076,22 +1008,22 @@ { "type": "data", "label": "job", - "GID": 264, + "GID": 139, "dtype": "DType.Data", "dtype state": "gASVpgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjCpweWlyb25fYXRvbWlzdGljcy5hdG9taXN0aWNzLmpvYi5hdG9taXN0aWOUjBNBdG9taXN0aWNHZW5lcmljSm9ilJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklIiMBHNpemWUjAFtlHUu" }, { "type": "data", "label": "field", - "GID": 265, + "GID": 140, "val": "gASVCgAAAAAAAACMBnZvbHVtZZQu", "dtype": "DType.Choice", - "dtype state": "gASVUgEAAAAAAAB9lCiMB2RlZmF1bHSUjAVzdGVwc5SMA3ZhbJRoAowDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZSMCGJ1aWx0aW5zlIwDc3RylJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBWl0ZW1zlI+UKIwGZm9yY2VzlIwHaW5kaWNlc5SMEGNvbXB1dGF0aW9uX3RpbWWUjAlmb3JjZV9tYXiUjAplbmVyZ3lfcG90lIwTdG90YWxfZGlzcGxhY2VtZW50c5RoAowJcHJlc3N1cmVzlIwTdW53cmFwcGVkX3Bvc2l0aW9uc5SMDWRpc3BsYWNlbWVudHOUjAt0ZW1wZXJhdHVyZZSMCXBvc2l0aW9uc5SMEWdldF9kaXNwbGFjZW1lbnRzlIwKZW5lcmd5X3RvdJSMBnZvbHVtZZSMBWNlbGxzlJB1Lg==" + "dtype state": "gASVUgEAAAAAAAB9lCiMB2RlZmF1bHSUjAVzdGVwc5SMA3ZhbJRoAowDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZSMCGJ1aWx0aW5zlIwDc3RylJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBWl0ZW1zlI+UKIwKZW5lcmd5X3BvdJSMC3RlbXBlcmF0dXJllIwKZW5lcmd5X3RvdJRoAowQY29tcHV0YXRpb25fdGltZZSME3RvdGFsX2Rpc3BsYWNlbWVudHOUjAlwb3NpdGlvbnOUjAdpbmRpY2VzlIwFY2VsbHOUjA1kaXNwbGFjZW1lbnRzlIwGZm9yY2VzlIwJcHJlc3N1cmVzlIwGdm9sdW1llIwTdW53cmFwcGVkX3Bvc2l0aW9uc5SMCWZvcmNlX21heJSMEWdldF9kaXNwbGFjZW1lbnRzlJB1Lg==" }, { "type": "data", "label": "transpose", - "GID": 266, + "GID": 141, "val": "gASILg==", "dtype": "DType.Boolean", "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -1099,7 +1031,7 @@ { "type": "data", "label": "index", - "GID": 267, + "GID": 142, "val": "gAROLg==", "dtype": "DType.Integer", "dtype state": "gASViQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANpbnSUk5SMBW51bXB5lIwHaW50ZWdlcpSTlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" @@ -1109,12 +1041,12 @@ { "type": "data", "label": "output", - "GID": 268, + "GID": 143, "dtype": "DType.List", "dtype state": "gASViQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANpbnSUk5RoCIwFZmxvYXSUk5SMBW51bXB5lIwGbnVtYmVylJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklIh1Lg==" } ], - "GID": 263, + "GID": 138, "pos x": 1204.8123746777428, "pos y": 35.48351648351648 }, @@ -1127,22 +1059,22 @@ { "type": "data", "label": "job", - "GID": 270, + "GID": 145, "dtype": "DType.Data", "dtype state": "gASVpgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjCpweWlyb25fYXRvbWlzdGljcy5hdG9taXN0aWNzLmpvYi5hdG9taXN0aWOUjBNBdG9taXN0aWNHZW5lcmljSm9ilJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklIiMBHNpemWUjAFtlHUu" }, { "type": "data", "label": "field", - "GID": 271, + "GID": 146, "val": "gASVDgAAAAAAAACMCmVuZXJneV9wb3SULg==", "dtype": "DType.Choice", - "dtype state": "gASVUgEAAAAAAAB9lCiMB2RlZmF1bHSUjAVzdGVwc5SMA3ZhbJRoAowDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZSMCGJ1aWx0aW5zlIwDc3RylJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBWl0ZW1zlI+UKIwGZm9yY2VzlIwHaW5kaWNlc5SMEGNvbXB1dGF0aW9uX3RpbWWUjAlmb3JjZV9tYXiUjAplbmVyZ3lfcG90lIwTdG90YWxfZGlzcGxhY2VtZW50c5RoAowJcHJlc3N1cmVzlIwTdW53cmFwcGVkX3Bvc2l0aW9uc5SMDWRpc3BsYWNlbWVudHOUjAt0ZW1wZXJhdHVyZZSMCXBvc2l0aW9uc5SMEWdldF9kaXNwbGFjZW1lbnRzlIwKZW5lcmd5X3RvdJSMBnZvbHVtZZSMBWNlbGxzlJB1Lg==" + "dtype state": "gASVUgEAAAAAAAB9lCiMB2RlZmF1bHSUjAVzdGVwc5SMA3ZhbJRoAowDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZSMCGJ1aWx0aW5zlIwDc3RylJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBWl0ZW1zlI+UKIwKZW5lcmd5X3BvdJSMC3RlbXBlcmF0dXJllIwKZW5lcmd5X3RvdJRoAowQY29tcHV0YXRpb25fdGltZZSME3RvdGFsX2Rpc3BsYWNlbWVudHOUjAlwb3NpdGlvbnOUjAdpbmRpY2VzlIwFY2VsbHOUjA1kaXNwbGFjZW1lbnRzlIwGZm9yY2VzlIwJcHJlc3N1cmVzlIwGdm9sdW1llIwTdW53cmFwcGVkX3Bvc2l0aW9uc5SMCWZvcmNlX21heJSMEWdldF9kaXNwbGFjZW1lbnRzlJB1Lg==" }, { "type": "data", "label": "transpose", - "GID": 272, + "GID": 147, "val": "gASILg==", "dtype": "DType.Boolean", "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -1150,7 +1082,7 @@ { "type": "data", "label": "index", - "GID": 273, + "GID": 148, "val": "gAROLg==", "dtype": "DType.Integer", "dtype state": "gASViQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANpbnSUk5SMBW51bXB5lIwHaW50ZWdlcpSTlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==" @@ -1159,78 +1091,226 @@ "outputs": [ { "type": "data", - "label": "output", - "GID": 274, + "label": "output", + "GID": 149, + "dtype": "DType.List", + "dtype state": "gASViQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjANpbnSUk5RoCIwFZmxvYXSUk5SMBW51bXB5lIwGbnVtYmVylJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklIh1Lg==" + } + ], + "GID": 144, + "pos x": 987.0180464050416, + "pos y": 308.010989010989 + }, + { + "identifier": "Project_Node", + "version": null, + "state data": "gAR9lC4=", + "additional data": {}, + "inputs": [ + { + "type": "data", + "label": "name", + "GID": 262, + "val": "gASVCwAAAAAAAACMB2V4YW1wbGWULg==", + "dtype": "DType.String", + "dtype state": 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158, - "parent node index": 2, - "output port index": 0, - "connected node": 3, "connected input port index": 1 }, { - "GID": 159, - "parent node index": 3, + "GID": 279, + "parent node index": 2, "output port index": 0, - "connected node": 4, + "connected node": 7, "connected input port index": 3 }, { - "GID": 275, + "GID": 156, "parent node index": 4, - "output port index": 1, - "connected node": 6, + "output port index": 0, + "connected node": 3, "connected input port index": 0 }, { - "GID": 276, - "parent node index": 4, - "output port index": 1, - "connected node": 7, - "connected input port index": 0 + "GID": 157, + "parent node index": 5, + "output port index": 0, + "connected node": 3, + "connected input port index": 1 }, { "GID": 278, "parent node index": 6, "output port index": 0, - "connected node": 5, + "connected node": 2, "connected input port index": 0 }, { - "GID": 277, + "GID": 280, "parent node index": 7, - "output port index": 0, + "output port index": 1, + "connected node": 4, + "connected input port index": 0 + }, + { + "GID": 281, + "parent node index": 7, + "output port index": 1, "connected node": 5, - "connected input port index": 1 + "connected input port index": 0 } ], - "GID": 86 + "GID": 90 }, - "GID": 80 + "GID": 84 }, { "title": "parameter_study", @@ -1238,36 +1318,6 @@ "flow": { "algorithm mode": "data", "nodes": [ - { - "identifier": "Project_Node", - "version": null, - "state data": "gAR9lC4=", - "additional data": {}, - "inputs": [ - { - "type": "data", - "label": "name", - "GID": 176, - "val": "gASVBQAAAAAAAACMAS6ULg==", - "dtype": "DType.String", - "dtype state": "gASVigAAAAAAAAB9lCiMB2RlZmF1bHSUjAEulIwDdmFslGgCjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwDc3RylJOUjAVudW1weZSMBHN0cl+Uk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UdS4=" - } - ], - "outputs": [ - { - "type": "data", - "label": "project", - "GID": 177, - "dtype": "DType.Data", - "dtype state": 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"gASVwgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiYwFaXRlbXOUXZQoTowCc2OUjANmY2OUjANiY2OUjANoY3CUjAdkaWFtb25klIwKemluY2JsZW5kZZSMCHJvY2tzYWx0lIwOY2VzaXVtY2hsb3JpZGWUjAhmbHVvcml0ZZSMCHd1cnR6aXRllGV1Lg==" @@ -1295,7 +1345,7 @@ { "type": "data", "label": "a", - "GID": 181, + "GID": 171, "val": "gAROLg==", "dtype": "DType.Float", "dtype state": "gASVmQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjAVmbG9hdJSTlIwFbnVtcHmUjAhmbG9hdGluZ5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZSMCGRlY2ltYWxzlEsKdS4=" @@ -1303,7 +1353,7 @@ { "type": "data", "label": "c", - "GID": 182, + "GID": 172, "val": "gAROLg==", "dtype": "DType.Float", "dtype state": "gASVmQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjAVmbG9hdJSTlIwFbnVtcHmUjAhmbG9hdGluZ5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZSMCGRlY2ltYWxzlEsKdS4=" @@ -1311,7 +1361,7 @@ { "type": "data", "label": "c_over_a", - "GID": 183, + "GID": 173, "val": "gAROLg==", "dtype": "DType.Float", "dtype state": "gASVmQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjAVmbG9hdJSTlIwFbnVtcHmUjAhmbG9hdGluZ5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZSMCGRlY2ltYWxzlEsKdS4=" @@ -1319,7 +1369,7 @@ { "type": "data", "label": "u", - "GID": 184, + "GID": 174, "val": "gAROLg==", "dtype": "DType.Float", "dtype state": "gASVmQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjAVmbG9hdJSTlIwFbnVtcHmUjAhmbG9hdGluZ5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZSMCGRlY2ltYWxzlEsKdS4=" @@ -1327,7 +1377,7 @@ { "type": "data", "label": "orthorhombic", - "GID": 185, + "GID": 175, "val": "gASJLg==", "dtype": "DType.Boolean", "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -1335,7 +1385,7 @@ { "type": "data", "label": "cubic", - "GID": 186, + "GID": 176, "val": "gASJLg==", "dtype": "DType.Boolean", "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -1345,14 +1395,14 @@ { "type": "data", "label": "structure", - "GID": 187, + "GID": 177, "dtype": "DType.Data", "dtype state": 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"dtype state": "gASVVQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiXUu" }, { "type": "exec", - "label": "remove", - "GID": 203, + "label": "reset", + "GID": 292, "val": "gAROLg==", "dtype": "DType.Untyped", "dtype state": "gASVVQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiXUu" @@ -1498,7 +1748,7 @@ { "type": "data", "label": "name", - "GID": 204, + "GID": 293, "val": "gASVDAAAAAAAAACMCGNhbGNfbWlulC4=", "dtype": "DType.String", "dtype state": "gASVjQAAAAAAAAB9lCiMB2RlZmF1bHSUjARjYWxjlIwDdmFslGgCjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwDc3RylJOUjAVudW1weZSMBHN0cl+Uk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UdS4=" @@ -1506,7 +1756,7 @@ { "type": "data", "label": "job", - "GID": 205, + "GID": 294, "dtype": "DType.Data", "dtype state": 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"GID": 306, + "parent node index": 3, "output port index": 0, - "connected node": 5, + "connected node": 8, "connected input port index": 3 }, { - "GID": 285, + "GID": 305, "parent node index": 5, - "output port index": 1, + "output port index": 0, "connected node": 8, + "connected input port index": 7 + }, + { + "GID": 229, + "parent node index": 6, + "output port index": 0, + "connected node": 4, "connected input port index": 0 }, { - "GID": 246, + "GID": 307, "parent node index": 7, "output port index": 0, - "connected node": 5, - "connected input port index": 7 + "connected node": 3, + "connected input port index": 0 }, { - "GID": 286, + "GID": 308, "parent node index": 8, - "output port index": 0, + "output port index": 1, "connected node": 6, "connected input port index": 0 } ], - "GID": 174 + "GID": 164 }, - "GID": 168 + "GID": 158 } ] } \ No newline at end of file diff --git a/notebooks/premade_bulk_modulus.json b/notebooks/premade_bulk_modulus.json index 199a1219..21e172ea 100644 --- a/notebooks/premade_bulk_modulus.json +++ b/notebooks/premade_bulk_modulus.json @@ -18,7 +18,7 @@ "GID": 9, "val": "gASVDwAAAAAAAACMC0J1bGtNb2R1bHVzlC4=", "dtype": "DType.Choice", - "dtype state": "gASVsQAAAAAAAAB9lCiMB2RlZmF1bHSUjBBNYXRlcmlhbFByb3BlcnR5lIwDdmFslGgCjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlIwIYnVpbHRpbnOUjANzdHKUk5RhjAphbGxvd19ub25llImMB2JhdGNoZWSUiYwFaXRlbXOUXZQoaAKMDVN1cmZhY2VFbmVyZ3mUjAtCdWxrTW9kdWx1c5SMBkJQcmltZZRldS4=" + "dtype state": "gASVsQAAAAAAAAB9lCiMB2RlZmF1bHSUjBBNYXRlcmlhbFByb3BlcnR5lIwDdmFslGgCjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlIwIYnVpbHRpbnOUjANzdHKUk5RhjAphbGxvd19ub25llImMB2JhdGNoZWSUiYwFaXRlbXOUXZQojAtCdWxrTW9kdWx1c5SMBkJQcmltZZRoAowNU3VyZmFjZUVuZXJneZRldS4=" }, { "type": "data", @@ -36,12 +36,14 @@ "label": "value", "GID": 11, "dtype": "DType.Float", - "dtype state": "gASVqQAAAAAAAAB9lCiMB2RlZmF1bHSURwAAAAAAAAAAjAN2YWyURwAAAAAAAAAAjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwFZmxvYXSUk5SMBW51bXB5lIwIZmxvYXRpbmeUk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UjAhkZWNpbWFsc5RLCnUu" + "dtype state": "gASVqQAAAAAAAAB9lCiMB2RlZmF1bHSURwAAAAAAAAAAjAN2YWyURwAAAAAAAAAAjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwFZmxvYXSUk5SMBW51bXB5lIwIZmxvYXRpbmeUk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UjAhkZWNpbWFsc5RLCnUu", + "otype_namespace": "atomistics", + "otype_name": "bulkmodulus3" } ], "GID": 8, - "pos x": 1404.4182452927373, - "pos y": 282.14285714285717 + "pos x": 1288.4101976511029, + "pos y": 181.98901098901098 }, { "identifier": "CalcMurnaghan_Node", @@ -59,7 +61,7 @@ }, { "type": "exec", - "label": "remove", + "label": "reset", "GID": 14, "val": "gAROLg==", "dtype": "DType.Untyped", @@ -187,8 +189,8 @@ } ], "GID": 12, - "pos x": 1059.3830481314028, - "pos y": 194.23076923076928 + "pos x": 903.4202234316815, + "pos y": 87.98901098901098 }, { "identifier": "Project_Node", @@ -203,13 +205,53 @@ "val": "gASVGAAAAAAAAACMFHByZW1hZGVfYnVsa19tb2R1bHVzlC4=", "dtype": "DType.String", "dtype state": "gASVigAAAAAAAAB9lCiMB2RlZmF1bHSUjAEulIwDdmFslGgCjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwDc3RylJOUjAVudW1weZSMBHN0cl+Uk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UdS4=" + }, + { + "type": "exec", + "label": "remove", + "GID": 32, + "val": "gAROLg==", + "dtype": "DType.Untyped", + "dtype state": "gASVVQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiXUu" + }, + { + "type": "data", + "label": "enable_remove", + "GID": 33, + "val": "gASJLg==", + "dtype": "DType.Boolean", + "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" + }, + { + "type": "data", + "label": "remove_name", + "GID": 34, + "val": "gASVBAAAAAAAAACMAJQu", + "dtype": "DType.String", + "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUjACUjAN2YWyUaAKMA2RvY5RoAowGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZQojAhidWlsdGluc5SMA3N0cpSTlIwFbnVtcHmUjARzdHJflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" + }, + { + "type": "data", + "label": "remove_all", + "GID": 35, + "val": "gASJLg==", + "dtype": "DType.Boolean", + "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" + }, + { + "type": "data", + "label": "recursive", + "GID": 36, + "val": "gASILg==", + "dtype": "DType.Boolean", + "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiIwDdmFslIiMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" } ], "outputs": [ { "type": "data", "label": "project", - "GID": 32, + "GID": 37, "dtype": "DType.Data", "dtype state": "gASViQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjBlweWlyb25fYXRvbWlzdGljcy5wcm9qZWN0lIwHUHJvamVjdJSTlGGMCmFsbG93X25vbmWUiYwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==", "otype_namespace": "atomistics", @@ -217,8 +259,8 @@ } ], "GID": 30, - "pos x": 255.0334802266354, - "pos y": 88.73626373626378 + "pos x": 191.8418791177313, + "pos y": 62.362637362637365 }, { "identifier": "Lammps_Node", @@ -229,7 +271,7 @@ { "type": "data", "label": "project", - "GID": 34, + "GID": 39, "dtype": "DType.Data", "dtype state": "gASViQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjBlweWlyb25fYXRvbWlzdGljcy5wcm9qZWN0lIwHUHJvamVjdJSTlGGMCmFsbG93X25vbmWUiYwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==", "otype_namespace": "atomistics", @@ -238,7 +280,7 @@ { "type": "data", "label": "structure", - "GID": 35, + "GID": 40, "dtype": "DType.Data", "dtype state": "gASVmgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjCxweWlyb25fYXRvbWlzdGljcy5hdG9taXN0aWNzLnN0cnVjdHVyZS5hdG9tc5SMBUF0b21zlJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu", "otype_namespace": "atomistics", @@ -247,7 +289,7 @@ { "type": "data", "label": "potential", - "GID": 36, + "GID": 41, "val": "gASVJwAAAAAAAACMIzE5OTctLUFja2xhbmQtRy1KLS1GZS0tTEFNTVBTLS1pcHIxlC4=", "dtype": "DType.Choice", "dtype state": 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" @@ -257,16 +299,16 @@ { "type": "data", "label": "engine", - "GID": 37, + "GID": 42, "dtype": "DType.Data", "dtype state": "gASVjgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjB9weWlyb25fYXRvbWlzdGljcy5sYW1tcHMubGFtbXBzlIwGTGFtbXBzlJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu", "otype_namespace": "atomistics", "otype_name": "lammps_output_job" } ], - "GID": 33, - "pos x": 648.4175585188576, - "pos y": 315.10989010989016 + "GID": 38, + "pos x": 549.2294471498138, + "pos y": 247.1098901098901 }, { "identifier": "BulkStructure_Node", @@ -277,7 +319,7 @@ { "type": "data", "label": "element", - "GID": 39, + "GID": 44, "val": "gASVBgAAAAAAAACMAkZllC4=", "dtype": "DType.String", "dtype state": "gASViwAAAAAAAAB9lCiMB2RlZmF1bHSUjAJGZZSMA3ZhbJRoAowDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZQojAhidWlsdGluc5SMA3N0cpSTlIwFbnVtcHmUjARzdHJflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu", @@ -287,7 +329,7 @@ { "type": "data", "label": "crystal_structure", - "GID": 40, + "GID": 45, "val": "gAROLg==", "dtype": "DType.Choice", "dtype state": "gASVwgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiYwFaXRlbXOUXZQoTowCc2OUjANmY2OUjANiY2OUjANoY3CUjAdkaWFtb25klIwKemluY2JsZW5kZZSMCHJvY2tzYWx0lIwOY2VzaXVtY2hsb3JpZGWUjAhmbHVvcml0ZZSMCHd1cnR6aXRllGV1Lg==" @@ -295,7 +337,7 @@ { "type": "data", "label": "a", - "GID": 41, + "GID": 46, "val": "gAROLg==", "dtype": "DType.Float", "dtype state": "gASVmQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjAVmbG9hdJSTlIwFbnVtcHmUjAhmbG9hdGluZ5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZSMCGRlY2ltYWxzlEsKdS4=" @@ -303,7 +345,7 @@ { "type": "data", "label": "c", - "GID": 42, + "GID": 47, "val": "gAROLg==", "dtype": "DType.Float", "dtype state": 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diff --git a/notebooks/premade_surface_energy.json b/notebooks/premade_surface_energy.json index f98358c9..8c873f7a 100644 --- a/notebooks/premade_surface_energy.json +++ b/notebooks/premade_surface_energy.json @@ -36,9 +36,7 @@ "label": "value", "GID": 11, "dtype": "DType.Float", - "dtype state": "gASVqQAAAAAAAAB9lCiMB2RlZmF1bHSURwAAAAAAAAAAjAN2YWyURwAAAAAAAAAAjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwFZmxvYXSUk5SMBW51bXB5lIwIZmxvYXRpbmeUk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UjAhkZWNpbWFsc5RLCnUu", - "otype_namespace": "atomistics", - "otype_name": "surfaceenergy3" + "dtype state": "gASVqQAAAAAAAAB9lCiMB2RlZmF1bHSURwAAAAAAAAAAjAN2YWyURwAAAAAAAAAAjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwFZmxvYXSUk5SMBW51bXB5lIwIZmxvYXRpbmeUk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UjAhkZWNpbWFsc5RLCnUu" } ], "GID": 8, @@ -103,258 +101,6 @@ "pos x": 1085.755165111887, "pos y": 281.31868131868134 }, - { - "identifier": 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" @@ -392,14 +138,14 @@ { "type": "data", "label": "engine", - "GID": 54, + "GID": 52, "dtype": "DType.Data", "dtype state": "gASVjgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjB9weWlyb25fYXRvbWlzdGljcy5sYW1tcHMubGFtbXBzlIwGTGFtbXBzlJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu", "otype_namespace": "atomistics", "otype_name": "lammps_output_job" } ], - "GID": 50, + "GID": 48, "pos x": 444.0336519201053, "pos y": 82.14285714285714 }, @@ -412,7 +158,7 @@ { "type": "data", "label": "element", - "GID": 57, + "GID": 54, "val": "gASVBgAAAAAAAACMAkZllC4=", "dtype": "DType.String", "dtype state": "gASViwAAAAAAAAB9lCiMB2RlZmF1bHSUjAJGZZSMA3ZhbJRoAowDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZQojAhidWlsdGluc5SMA3N0cpSTlIwFbnVtcHmUjARzdHJflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu", @@ -422,7 +168,7 @@ { "type": "data", "label": "crystal_structure", - "GID": 58, + "GID": 55, "val": "gAROLg==", "dtype": "DType.Choice", "dtype state": "gASVwgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiYwFaXRlbXOUXZQoTowCc2OUjANmY2OUjANiY2OUjANoY3CUjAdkaWFtb25klIwKemluY2JsZW5kZZSMCHJvY2tzYWx0lIwOY2VzaXVtY2hsb3JpZGWUjAhmbHVvcml0ZZSMCHd1cnR6aXRllGV1Lg==" @@ -430,7 +176,7 @@ { "type": "data", "label": "a", - "GID": 59, + "GID": 56, "val": "gAROLg==", "dtype": "DType.Float", "dtype state": "gASVmQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjAVmbG9hdJSTlIwFbnVtcHmUjAhmbG9hdGluZ5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZSMCGRlY2ltYWxzlEsKdS4=" @@ -438,7 +184,7 @@ { "type": "data", "label": "c", - "GID": 60, + "GID": 57, "val": "gAROLg==", "dtype": "DType.Float", "dtype state": "gASVmQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjAVmbG9hdJSTlIwFbnVtcHmUjAhmbG9hdGluZ5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZSMCGRlY2ltYWxzlEsKdS4=" @@ -446,7 +192,7 @@ { "type": "data", "label": "c_over_a", - "GID": 61, + "GID": 58, "val": "gAROLg==", "dtype": "DType.Float", "dtype state": "gASVmQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjAVmbG9hdJSTlIwFbnVtcHmUjAhmbG9hdGluZ5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZSMCGRlY2ltYWxzlEsKdS4=" @@ -454,7 +200,7 @@ { "type": "data", "label": "u", - "GID": 62, + "GID": 59, "val": "gAROLg==", "dtype": "DType.Float", "dtype state": "gASVmQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjAVmbG9hdJSTlIwFbnVtcHmUjAhmbG9hdGluZ5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZSMCGRlY2ltYWxzlEsKdS4=" @@ -462,7 +208,7 @@ { "type": "data", "label": "orthorhombic", - "GID": 63, + "GID": 60, "val": "gASJLg==", "dtype": "DType.Boolean", "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -470,7 +216,7 @@ { "type": "data", "label": "cubic", - "GID": 64, + "GID": 61, "val": "gASJLg==", "dtype": "DType.Boolean", "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -480,16 +226,16 @@ { "type": "data", "label": "structure", - "GID": 65, + "GID": 62, "dtype": "DType.Data", "dtype state": "gASVmgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjCxweWlyb25fYXRvbWlzdGljcy5hdG9taXN0aWNzLnN0cnVjdHVyZS5hdG9tc5SMBUF0b21zlJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu", "otype_namespace": "atomistics", "otype_name": "bulk_structure_output_structure" } ], - "GID": 56, - "pos x": 107.78916041893207, - "pos y": 128.2967032967033 + "GID": 53, + "pos x": 104.84101976511027, + "pos y": 225.06593406593407 }, { "identifier": "Lammps_Node", @@ -500,7 +246,7 @@ { "type": "data", "label": "project", - "GID": 68, + "GID": 64, "dtype": "DType.Data", "dtype state": "gASViQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjBlweWlyb25fYXRvbWlzdGljcy5wcm9qZWN0lIwHUHJvamVjdJSTlGGMCmFsbG93X25vbmWUiYwHYmF0Y2hlZJSJjARzaXpllIwBbZR1Lg==", "otype_namespace": "atomistics", @@ -509,7 +255,7 @@ { "type": "data", "label": "structure", - "GID": 69, + "GID": 65, "dtype": "DType.Data", "dtype state": "gASVmgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjCxweWlyb25fYXRvbWlzdGljcy5hdG9taXN0aWNzLnN0cnVjdHVyZS5hdG9tc5SMBUF0b21zlJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu", "otype_namespace": "atomistics", @@ -518,7 +264,7 @@ { "type": "data", "label": "potential", - "GID": 70, + "GID": 66, "val": "gASVJwAAAAAAAACMIzE5OTctLUFja2xhbmQtRy1KLS1GZS0tTEFNTVBTLS1pcHIxlC4=", "dtype": "DType.Choice", "dtype state": "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" @@ -528,14 +274,14 @@ { "type": "data", "label": "engine", - "GID": 71, + "GID": 67, "dtype": "DType.Data", "dtype state": "gASVjgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjB9weWlyb25fYXRvbWlzdGljcy5sYW1tcHMubGFtbXBzlIwGTGFtbXBzlJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu", "otype_namespace": "atomistics", "otype_name": "lammps_output_job" } ], - "GID": 67, + "GID": 63, "pos x": 450.62668116522633, "pos y": 519.5054945054945 }, @@ -548,7 +294,7 @@ { "type": "data", "label": "element", - "GID": 74, + "GID": 69, "val": "gASVBgAAAAAAAACMAkZllC4=", "dtype": "DType.String", "dtype state": "gASViwAAAAAAAAB9lCiMB2RlZmF1bHSUjAJGZZSMA3ZhbJRoAowDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZQojAhidWlsdGluc5SMA3N0cpSTlIwFbnVtcHmUjARzdHJflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -556,7 +302,7 @@ { "type": "data", "label": "surface_type", - "GID": 75, + "GID": 70, "val": "gASVCgAAAAAAAACMBmJjYzEwMJQu", "dtype": "DType.Choice", "dtype state": "gASV0QAAAAAAAAB9lCiMB2RlZmF1bHSUjAZiY2MxMDCUjAN2YWyUaAKMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjAphbGxvd19ub25llIiMB2JhdGNoZWSUiYwFaXRlbXOUXZQoaAKMBmJjYzExMJSMBmJjYzExMZSMCmRpYW1vbmQxMDCUjApkaWFtb25kMTExlIwGZmNjMTAwlIwGZmNjMTEwlIwGZmNjMTExlIwGZmNjMjExlIwHaGNwMDAwMZSMCGhjcDEwbTEwlGV1Lg==" @@ -564,7 +310,7 @@ { "type": "data", "label": "size_a", - "GID": 76, + "GID": 71, "val": "gARLAS4=", "dtype": "DType.Integer", "dtype state": "gASViwAAAAAAAAB9lCiMB2RlZmF1bHSUSwGMA3ZhbJRLAYwDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZQojAhidWlsdGluc5SMA2ludJSTlIwFbnVtcHmUjAdpbnRlZ2VylJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -572,7 +318,7 @@ { "type": "data", "label": "size_b", - "GID": 77, + "GID": 72, "val": "gARLAS4=", "dtype": "DType.Integer", "dtype state": "gASViwAAAAAAAAB9lCiMB2RlZmF1bHSUSwGMA3ZhbJRLAYwDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZQojAhidWlsdGluc5SMA2ludJSTlIwFbnVtcHmUjAdpbnRlZ2VylJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -580,7 +326,7 @@ { "type": "data", "label": "size_c", - "GID": 78, + "GID": 73, "val": "gARLAS4=", "dtype": "DType.Integer", "dtype state": "gASViwAAAAAAAAB9lCiMB2RlZmF1bHSUSwGMA3ZhbJRLAYwDZG9jlIwAlIwGYm91bmRzlE6MDXZhbGlkX2NsYXNzZXOUXZQojAhidWlsdGluc5SMA2ludJSTlIwFbnVtcHmUjAdpbnRlZ2VylJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -588,7 +334,7 @@ { "type": "data", "label": "vacuum", - "GID": 79, + "GID": 74, "val": "gASVCgAAAAAAAABHQCQAAAAAAAAu", "dtype": "DType.Float", "dtype state": "gASVqQAAAAAAAAB9lCiMB2RlZmF1bHSUR0AkAAAAAAAAjAN2YWyUR0AkAAAAAAAAjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwFZmxvYXSUk5SMBW51bXB5lIwIZmxvYXRpbmeUk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UjAhkZWNpbWFsc5RLCnUu" @@ -596,7 +342,7 @@ { "type": "data", "label": "center", - "GID": 80, + "GID": 75, "val": "gASJLg==", "dtype": "DType.Boolean", "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiYwDdmFslImMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -604,7 +350,7 @@ { "type": "data", "label": "orthogonal", - "GID": 81, + "GID": 76, "val": "gASILg==", "dtype": "DType.Boolean", "dtype state": "gASViAAAAAAAAAB9lCiMB2RlZmF1bHSUiIwDdmFslIiMA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjARib29slJOUjAVudW1weZSMBWJvb2xflJOUZYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu" @@ -612,7 +358,7 @@ { "type": "data", "label": "a", - "GID": 82, + "GID": 77, "val": "gAROLg==", "dtype": "DType.Float", "dtype state": "gASVmQAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UKIwIYnVpbHRpbnOUjAVmbG9hdJSTlIwFbnVtcHmUjAhmbG9hdGluZ5STlGWMCmFsbG93X25vbmWUiIwHYmF0Y2hlZJSJjARzaXpllIwBbZSMCGRlY2ltYWxzlEsKdS4=" @@ -622,16 +368,16 @@ { "type": "data", "label": "structure", - "GID": 83, + "GID": 78, "dtype": "DType.Data", "dtype state": "gASVmgAAAAAAAAB9lCiMB2RlZmF1bHSUTowDdmFslE6MA2RvY5SMAJSMBmJvdW5kc5ROjA12YWxpZF9jbGFzc2VzlF2UjCxweWlyb25fYXRvbWlzdGljcy5hdG9taXN0aWNzLnN0cnVjdHVyZS5hdG9tc5SMBUF0b21zlJOUYYwKYWxsb3dfbm9uZZSJjAdiYXRjaGVklImMBHNpemWUjAFtlHUu", "otype_namespace": "atomistics", "otype_name": "surface_structure_output_structure" } ], - "GID": 73, - "pos x": 114.38218966405312, - "pos y": 482.14285714285717 + "GID": 68, + "pos x": 106.49006622516555, + "pos y": 497.8955223880597 }, { "identifier": "Project_Node", @@ -642,105 +388,397 @@ { "type": "data", "label": "name", - "GID": 86, + "GID": 94, "val": "gASVCwAAAAAAAACMB3N1cmZhY2WULg==", "dtype": "DType.String", "dtype state": "gASVigAAAAAAAAB9lCiMB2RlZmF1bHSUjAEulIwDdmFslGgCjANkb2OUjACUjAZib3VuZHOUTowNdmFsaWRfY2xhc3Nlc5RdlCiMCGJ1aWx0aW5zlIwDc3RylJOUjAVudW1weZSMBHN0cl+Uk5RljAphbGxvd19ub25llImMB2JhdGNoZWSUiYwEc2l6ZZSMAW2UdS4=" + }, + { 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